13zg

PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z381408780

Method: X-RAY DIFFRACTION D_max: 70.6 Å Quality: EXCELLENT

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1. 蛋白身份与相关结构 Protein Identity & Related Structures

3Dpol RNA Dependent RNA Polymerase

enterovirus D68

当前结构中的状态

Assembly	聚集状态	构建体	突变与修饰	配体、离子与共同组分	实验方法与环境	结构质量
1	蛋白单体单体蛋白 × 1 PDB 声明：monomeric（1）与蛋白拷贝数一致	链 A； UniProt 1732–2188	未记录	IPA ISOPROPYL ALCOHOL × 16 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BFI N,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件：VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.198

数据库中的同蛋白其他状态

以下每一行都是同一 UniProt 蛋白在另一个 PDB 条目中的 biological assembly， “相对当前条目”直接指出证据层面的不同；没有差异标签表示当前已读取字段一致。

其他 PDB	相对当前条目 13ZG	Assembly / 聚集状态	构建体	突变与修饰	配体、离子与非聚合物	实验方法与环境	结构质量
13XK PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z111507846 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 AWP 1-cyclohexyl-3-(2-pyridin-4-ylethyl)urea × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.77 Å R-free 0.252
13XL PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1143279263 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UR7 1-(3-fluoro-4-methylphenyl)methanesulfonamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.64 Å R-free 0.240
13XM PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1198177230 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 K6U (2M)-2-(2-methoxyphenyl)-1,3,4-oxadiazole × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.61 Å R-free 0.226
13XN PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1201620232 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 16 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 NZ1 5-methoxy-1,3-benzothiazol-2-amine × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.45 Å R-free 0.217
13XO PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1203107138 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 JH1 1-ethyl-N-[(4-fluorophenyl)methyl]-1H-pyrazole-4-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.206
13XP PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1203191681 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1AJ1 N-[(1H-imidazol-2-yl)methyl]acetamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.60 Å R-free 0.212
13XQ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1220452176 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 HWH ~{N}-[2-(5-fluoranyl-1~{H}-indol-3-yl)ethyl]ethanamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.39 Å R-free 0.225
13XR PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1222424326 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 S7J 2-(trifluoromethyl)pyrimidine-5-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.47 Å R-free 0.223
13XS PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1230130478 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9Q N,N-dimethyl-2-[(propan-2-yl)amino]pyridine-3-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.210
13XT PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1230795916 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BMO 1-methyl-N-(2-methylpropyl)-1H-imidazole-2-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.215
13XU PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1231609616 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 16 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9T 5-chloro-N-cyclopropylpyridine-2-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.211
13XV PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1250129088 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9S N-(3-hydroxy-4-methylphenyl)furan-2-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.53 Å R-free 0.221
13XW PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1265813904 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 R60 7-fluoranyl-~{N},~{N}-dimethyl-1-benzofuran-2-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.74 Å R-free 0.216
13XX PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1270393711 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 Z5C 5-(methoxymethyl)-1,2-oxazole-3-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.48 Å R-free 0.236
13XY PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1295863442 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UR1 3-fluoro-5-methylbenzene-1-sulfonamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.211
13XZ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z133716556 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 Z3H N-[(4R)-3,4-dihydro-2H-1-benzopyran-4-yl]methanesulfonamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.82 Å R-free 0.271
13YA PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1373445602 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 SZE 4-(3-fluoranylpyridin-2-yl)-1-methyl-piperazin-2-one × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.60 Å R-free 0.228
13YB PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1398461996 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 TM0 (1R)-1-(3-benzyl-1,2,4-oxadiazol-5-yl)ethan-1-amine × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.35 Å R-free 0.202
13YC PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1401276297 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1H97 (5~{R})-7-pyrazin-2-yl-2-oxa-7-azaspiro[4.4]nonane × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.208
13YD PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1428159350 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9U (1R)-1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethan-1-amine × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.74 Å R-free 0.213
13YE PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1509191464 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 GOL GLYCEROL × 1 WKA N-(2,1,3-benzoxadiazol-4-yl)acetamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.211
13YF PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1563512128 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 M0J N-[(2S)-2-hydroxypropyl]-N'-phenylurea × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.45 Å R-free 0.207
13YG PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1685106505 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 TQC (3M)-5-cyclobutyl-3-(1-methyl-1H-imidazol-2-yl)-1,2,4-oxadiazole × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.81 Å R-free 0.238
13YH PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z169675004 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 YDX N-(1-methyl-1H-pyrazol-3-yl)-2-(1H-pyrazol-1-yl)acetamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.67 Å R-free 0.215
13YI PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1730522163 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9X 1-[(2R)-8-fluoro-2-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl]ethan-1-one × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.39 Å R-free 0.205
13YJ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z1891773476 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BNE 1-[(2R)-2,3-dihydro-1,4-benzodioxin-2-yl]-N-methylmethanamine × 1 DMS DIMETHYL SULFOXIDE × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.62 Å R-free 0.225
13YK PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z190780124 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9Y N-[(1S)-1-cyclopropylethyl]-2-oxo-1,2-dihydropyridine-3-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.57 Å R-free 0.249
13YL PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z192955056 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 Q4L methyl 4-(4-fluorophenyl)piperazine-1-carboxylate × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.83 Å R-free 0.289
13YM PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z19727416 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 W0M (2R)-2-(4-chlorophenoxy)propanamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.205
13YN PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z19733482 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1AND N,N-dimethyl-2-(2-methylphenoxy)acetamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.77 Å R-free 0.221
13YO PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z19735981 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 VVY 2-phenoxy-1-(pyrrolidin-1-yl)ethan-1-one × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.47 Å R-free 0.226
13YP PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z19755216 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 TT3 2-(3-fluorophenoxy)-N,N-dimethylacetamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.57 Å R-free 0.210
13YQ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z198194394 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 O1M 4-(4-fluorophenyl)piperazine-1-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.212
13YR PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z198195770 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 LJA N-[3-(carbamoylamino)phenyl]acetamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.83 Å R-free 0.234
13YS PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z204776284 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C9Z N~2~-cycloheptyl-N,N~2~-dimethylglycinamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.41 Å R-free 0.233
13YT PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z2092555279 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BE7 (3R)-3-ethyl-1-(5-fluoropyridin-2-yl)pyrrolidin-3-ol × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.71 Å R-free 0.225
13YU PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z239127550 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C90 2-(3-aminophenoxy)-1-(pyrrolidin-1-yl)ethan-1-one × 4 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.46 Å R-free 0.217
13YV PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z240297434 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 K0M 3-methyl-N-(1-methyl-1H-pyrazol-3-yl)-1,2-oxazole-5-carboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.202
13YW PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z26333448 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 GQP 1-[(4-fluorophenyl)methyl]benzimidazole × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.77 Å R-free 0.244
13YX PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z274555794 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 NZ4 N-(3-acetylphenyl)morpholine-4-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.55 Å R-free 0.223
13YY PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z275151340 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 JHP 4-chloro-N-cyclopentyl-1-methyl-1H-pyrazole-3-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.200
13YZ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z285233820 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 KB3 (5M)-5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-amine × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.45 Å R-free 0.215
13ZA PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z2856434866 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C92 (1r,4R)-4-ethyl-N-{[(2R)-oxolan-2-yl]methyl}cyclohexan-1-amine × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.40 Å R-free 0.209
13ZB PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z285782452 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 16 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UVA N-methyl-2-(methylsulfonyl)aniline × 2	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.44 Å R-free 0.210
13ZC PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z3015133857 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C91 [1-(4-fluorophenyl)cyclobutyl][4-(methylamino)piperidin-1-yl]methanone × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.43 Å R-free 0.208
13ZD PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z30620520 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 GX4 cyclopropyl-[4-(4-fluorophenyl)piperazin-1-yl]methanone × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.59 Å R-free 0.223
13ZE PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z32367954 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UXA ~{N}-cyclopropyl-1,3-benzodioxole-5-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.42 Å R-free 0.214
13ZF PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z374427992 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BFG N-{[2-(dimethylamino)pyridin-4-yl]methyl}acetamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.66 Å R-free 0.214
13ZH PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z381474098 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 SZX (2R)-N-(pyridin-2-yl)-1,4-dioxane-2-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.66 Å R-free 0.211
13ZI PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z384361454 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BMW 3-methyl-N-{[(3S)-oxolan-3-yl]methyl}-1,2-oxazole-5-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.204
13ZJ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z384362790 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C93 N-{[(3S)-oxolan-3-yl]methyl}pyrazine-2-carboxamide × 2	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.50 Å R-free 0.210
13ZK PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z390185328 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 WL7 4-amino-N-(2-hydroxyethyl)-N-methylbenzene-1-sulfonamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.38 Å R-free 0.226
13ZL PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z415636694 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 NY4 N-{4-[(1S)-1-aminoethyl]phenyl}cyclopropanecarboxamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.200
13ZM PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z431546706 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UQS N-[(2-fluorophenyl)methyl]-1H-pyrazol-4-amine × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.235
13ZN PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z432057220 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UVG N,N-dimethyl-1H-pyrazole-4-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.76 Å R-free 0.292
13ZO PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z445191014 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 UXJ 2-fluoro-N-[(3-methyl-1H-pyrazol-4-yl)methyl]aniline × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.51 Å R-free 0.233
13ZP PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z45527714 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 X0S 2-chloro-N-methylbenzene-1-sulfonamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.72 Å R-free 0.230
13ZQ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z509756472 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 JGG N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.80 Å R-free 0.259
13ZR PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z53860899 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 STV ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.50 Å R-free 0.225
13ZS PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z54226006 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 NX7 (2,6-difluorophenyl)(pyrrolidin-1-yl)methanone × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.60 Å R-free 0.217
13ZT PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z55222357 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 ZV2 2-(2-azanyl-1,3-thiazol-3-yl)-~{N}-(4-fluorophenyl)ethanamide × 2 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.209
13ZU PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z55993012 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1ANC 4-amino-N,N-diethylbenzamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.51 Å R-free 0.238
13ZV PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z56040660 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C94 2-amino-N-[(2S)-butan-2-yl]benzamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.59 Å R-free 0.243
13ZW PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z56755030 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1C95 4-[(pyridin-4-yl)methyl]aniline × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.78 Å R-free 0.226
13ZX PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z56953052 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 14 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 A1BDK 1-(4-fluorobenzene-1-sulfonyl)piperazine × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.48 Å R-free 0.222
13ZY PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z57260516 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 B0V 2-methoxy-~{N}-(2,4,6-trimethylphenyl)ethanamide × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.206
13ZZ PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z57328552 提交 2026-03-06	配体/离子不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1 RX7 2-methyl-2-{[(3-methylthiophen-2-yl)methyl]amino}propan-1-ol × 1 MG MAGNESIUM ION × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1 M TRIS-HCl (pH 8.5), 16% PEG 3350, 16% Isopropanol	分辨率 1.52 Å R-free 0.242
14AA PanDDA analysis group deposition of ground-state model of Enterovirus D68 3Dpol 提交 2026-03-18	配体/离子不同实验环境不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）	未记录	IPA ISOPROPYL ALCOHOL × 15 PEG DI(HYDROXYETHYL)ETHER × 1 GOL GLYCEROL × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289 K；0.1M Tris-HCl, 16% PEG 3350, 16% Isopropanol	分辨率 1.34 Å R-free 0.200
5XE0 Crystal structure of EV-D68-3Dpol in complex with GTP 提交 2017-03-30	构建体不同突变/修饰不同配体/离子不同实验环境不同结构质量不同	Assembly 1 蛋白单体单体；蛋白 × 1 PDB 声明：monomeric	链 A 1732–2188（457 aa）片段：UNP residues 1732-2188	突变：V17A	GTP GUANOSINE-5'-TRIPHOSPHATE × 1	X-RAY DIFFRACTION X-ray结晶条件 VAPOR DIFFUSION, SITTING DROP；pH 8.5；289.15 K；0.1 M Tris-HCl pH 8.5, 20.1% isopropanol, 20.1% PEG 3350	分辨率 2.30 Å R-free 0.267

共 69 个其他 PDB 条目、69 个 assembly。打开独立比较页并筛选聚集状态

查看构建体与数据证据

UniProt名称	F1T146_HED68
Isoform	—
PDB实体	1
链与序列区间	作者链 A； PDB构建体 1–457； UniProt 1732–2188

页面优先展示蛋白身份、当前 assembly、共同组分、聚集状态和跨 PDB 结构链接。链映射与序列区间收在“数据证据”中；数据库内部编号、导入时间和 assembly 操作表达式仅用于维护，因此不在读者页面展示。

SAXS 散射曲线 SAXS Profile

P(r) 距离分布 P(r) Distribution

下载 Download SAXS (.dat) P(r) (.pr.out) CIF

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2. 结构基本信息 2. Structure Basics

条目编号 entry_id	13zg
沉积日期 deposition_date	2026-03-06
最后修订 last_revision	2026-03-18
结构标题 title	PanDDA analysis group deposition -- Crystal Structure of Enterovirus D68 3Dpol in complex with Z381408780
关键词 keywords	SGC - Diamond I04-1 fragment screening, PanDDA, XChemExplorer, RNA-dependent RNA polymerase, TRANSFERASE; TRANSFERASE
实验方法 method	X-RAY DIFFRACTION

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3. SAXS 参数 (CRYSOL 理论计算) 3. SAXS Parameters (CRYSOL)

回转半径 Rg (Guinier) rg_guinier	23.98 Å
回转半径 Rg (电子) rg_electron	23.04 Å
零角强度 I(0) i0	85891800.00
分子量 molecular_weight	49452.0 kDa
排除体积 excluded_volume	48309 Å³
包络体积 envelope_volume	82700 Å³
水化壳体积 shell_volume	29207 Å³
包络直径 envelope_diameter	73.7 Å
壳层 Rg shell_rg	30.70 Å
包络 Rg envelope_rg	22.83 Å
形状 Rg shape_rg	23.03 Å
总 Rg total_rg	23.72 Å
总原子数 total_atoms	3747
残基数 n_residues	457
球谐函数阶数 n_harmonics	20
q 范围 q_range	— – 0.5000 Å⁻¹
数据点数 n_points	101
壳层类型 shell_type	directional
溶剂电子密度 solvent_density	0.3340 e/Å³
壳层衬度 contrast_shell	0.0300 e/Å³
CRYSOL 版本 crysol_version	4.1.3

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4. P(r) 距离分布 (GNOM 反演) 4. P(r) Analysis (GNOM)

最大尺寸 Dmax dmax	70.6 Å
Rg (实空间) rg_real	23.77 Å
Rg 误差 (实空间) rg_real_error	0.32 Å
I(0) (实空间) i0_real	8.5890e+07
I(0) 误差 (实空间) i0_real_error	1.2270e+06
Rg (倒空间) rg_reciprocal	23.82 Å
I(0) (倒空间) i0_reciprocal	85890000.0000
解质量估计 total_estimate	0.9113
解质量评级 solution_quality	EXCELLENT a EXCELLENT solution
P(r) 峰数 n_peaks	2
主峰位置 r_peak_primary	33.1 Å
偏度 Skewness skewness	0.017
峰度 Kurtosis kurtosis	-0.593
角度范围 angular_range	— – 0.3300 Å⁻¹
当前正则化参数 α current_alpha	0.0000
最高正则化参数 α highest_alpha	20450000.0000
实空间数据点数 n_real_points	65
GNOM 版本 gnom_version	4.1.3
质量判据 quality_criteria	AN1: 0.000; Oscil: 0.956; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.982; Smooth: 0.994

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5. 晶体学与实验 5. Crystallography & Experiment

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6. 实体与聚合物信息 Entities & Polymers (7)

实体 1 Entity 1 polymer

描述 description	3Dpol RNA Dependent RNA Polymerase
分子量 formula_weight	52958.3 kDa
EC 编号 ec_number	3.4.22.29,3.6.1.15,3.4.22.28,2.7.7.48
来源方法 src_method	man
拷贝数 entity_count	1

聚合物 Polymer

聚合物类型 type	polypeptide(L)
链编号 strand_id	A
原子数 atom_count	4070

GEIVSNEKSGVCINAPAKTKLQPSVFHQVFEGSKEPAVLNSKDPRLKTDFEEAIFSKYTGNKIMLMDEYMEEAVDHYVGCLEPLDISVDPIPLESAMYGMDGLEALDLTTSAGFPYLLQGKKKRDIFNRHTRDTTEMTKMLEKYGVDLPFVTFVKDELRSKEKVEKGKSRLIEASSLNDSVAMRVAFGNLYATFHSNPGTATGSAVGCDPDIFWSKIPILLDGEIFAFDYTGYDASLSPVWFACLKKVLIKLGYTHQTSFIDYLCHSVHLYKDRKYIVNGGMPSGSSGTSIFNTMINNIIIRTLLIRVYKGIDLDQFKMIAYGDDVIASYPHKIDPALLAEAGKHYGLVMTPADKGTSFVDTNWENVTFLKRYFRADDQYPFLIHPVMPMKEIHESIRWTKDPRNTQDHVRSLCYLAWHNGEEAYNEFCRKIRSVPVGRALTLPAYSSLRRKWLDSFGSSGHHHHHH

来源 Source

来源生物 organism	enterovirus D68
NCBI 分类编号 ncbi_taxonomy_id	42789
宿主生物 host_organism	Escherichia coli

实体 2 Entity 2 non-polymer

描述 description	ISOPROPYL ALCOHOL
分子量 formula_weight	60.1 kDa
来源方法 src_method	syn
拷贝数 entity_count	16

实体 3 Entity 3 non-polymer

描述 description	DI(HYDROXYETHYL)ETHER
分子量 formula_weight	106.1 kDa
来源方法 src_method	syn
拷贝数 entity_count	1

实体 4 Entity 4 non-polymer

描述 description	GLYCEROL
分子量 formula_weight	92.1 kDa
来源方法 src_method	syn
拷贝数 entity_count	1

实体 5 Entity 5 non-polymer

描述 description	N,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide
分子量 formula_weight	204.3 kDa
来源方法 src_method	syn
拷贝数 entity_count	2

实体 6 Entity 6 non-polymer

描述 description	MAGNESIUM ION
分子量 formula_weight	24.3 kDa
来源方法 src_method	syn
拷贝数 entity_count	1

实体 7 Entity 7 water

描述 description	water
分子量 formula_weight	18.0 kDa
来源方法 src_method	nat
拷贝数 entity_count	323

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8. 引用文献 (1)

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晶胞边长 a length_a	55.457 Å
晶胞边长 b length_b	83.488 Å
晶胞边长 c length_c	58.814 Å
晶胞夹角 α angle_alpha	90.00 °
晶胞夹角 β angle_beta	108.40 °
晶胞夹角 γ angle_gamma	90.00 °
晶胞分子数 Z z_pdb	2

空间群 space_group	P 1 21 1
空间群编号 int_tables_number	4
晶系 crystal_system	—

分辨率 resolution	1.340 Å
最低分辨率 resolution_low	55.810 Å
R 因子 r_factor	0.1772
R_work r_work	0.1761
R_free r_free	0.1976

fit	/app/data/saxs_computation/3z/13zg/13zg.fit
pddf	/app/data/pr_computation/3z/13zg/13zg.pr.out
profile	/app/data/saxs_computation/3z/13zg/13zg.dat