1lwu

Crystal structure of fragment D from lamprey fibrinogen complexed with the peptide Gly-His-Arg-Pro-amide

Method: X-RAY DIFFRACTION D_max: 285.4 Å Quality: GOOD

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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1. 结构基本信息 1. Structure Basics

条目编号 entry_id	1lwu
沉积日期 deposition_date	2002-06-03
结构标题 title	Crystal structure of fragment D from lamprey fibrinogen complexed with the peptide Gly-His-Arg-Pro-amide
关键词 keywords	heterotrimer, protein-peptide complex, BLOOD CLOTTING; BLOOD CLOTTING
实验方法 method	X-RAY DIFFRACTION

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2. SAXS 参数 (CRYSOL 理论计算) 2. SAXS Parameters (CRYSOL)

回转半径 Rg (Guinier) rg_guinier	— Å
回转半径 Rg (电子) rg_electron	114.40 Å
零角强度 I(0) i0	1833040000.00
分子量 molecular_weight	346400.0 kDa
排除体积 excluded_volume	427110 Å³
包络体积 envelope_volume	849380 Å³
水化壳体积 shell_volume	83471 Å³
包络直径 envelope_diameter	448.3 Å
壳层 Rg shell_rg	60.31 Å
包络 Rg envelope_rg	115.70 Å
形状 Rg shape_rg	114.50 Å
总 Rg total_rg	113.10 Å
总原子数 total_atoms	24360
残基数 n_residues	2932
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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3. P(r) 距离分布 (GNOM 反演) 3. P(r) Analysis (GNOM)

最大尺寸 Dmax dmax	285.4 Å
Rg (实空间) rg_real	97.24 Å
Rg 误差 (实空间) rg_real_error	1.78 Å
I(0) (实空间) i0_real	1.7310e+09
I(0) 误差 (实空间) i0_real_error	3.6990e+07
Rg (倒空间) rg_reciprocal	90.81 Å
I(0) (倒空间) i0_reciprocal	1731000000.0000
解质量估计 total_estimate	0.7832
解质量评级 solution_quality	GOOD a GOOD solution
P(r) 峰数 n_peaks	2
主峰位置 r_peak_primary	40.8 Å
偏度 Skewness skewness	0.284
峰度 Kurtosis kurtosis	-0.993
角度范围 angular_range	— – 0.0700 Å⁻¹
当前正则化参数 α current_alpha	0.3314
最高正则化参数 α highest_alpha	34310000.0000
实空间数据点数 n_real_points	15
GNOM 版本 gnom_version	4.1.3
质量判据 quality_criteria	AN1: 0.042; Oscil: 0.604; Stabil: 0.982; Sysdev: 1.000; Positv: 1.000; Valcen: 0.576; Smooth: 0.000

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4. 晶体学与实验 4. Crystallography & Experiment

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5. 实体与聚合体信息 (11)

Entity 1 polymer

描述 description	Fibrinogen alpha-1 chain
分子量 formula_weight	14074.1 kDa
来源方法 src_method	nat
拷贝数 entity_count	4

聚合体 Polymer

聚合体类型 type	polypeptide(L)
链编号 strand_id	A,D,G,J
原子数 atom_count	24360

AVSDTSGQTLNEHNELEVRYSEVLRELERRIIHLQRRINMQLQQLTLLQHNIKTQVSQILRVEVDIDVALRACKGSCARYLEYRLDKEKNLQLEKAASYIANLKFERFEEVVVEETLNR

Entity 2 polymer

描述 description	Fibrinogen beta chain
分子量 formula_weight	37061.2 kDa
来源方法 src_method	nat
拷贝数 entity_count	4

聚合体 Polymer

聚合体类型 type	polypeptide(L)
链编号 strand_id	B,E,H,K

SSTHVNAQKEIENRYKEVKIRIESTVAGSLRSMKSVLEHLRAKMQRMEEAIKTQKELCSAPCTVNCRVPVVSGMHCEDIYRNGGRTSEAYYIQPDLFSEPYKVFCDMESHGGGWTVVQNRVDGSSNFARDWNTYKAEFGNIAFGNGKSICNIPGEYWLGTKTVHQLTKQHTQQVLFDMSDWEGSSVYAQYASFRPENEAQGYRLWVEDYSGNAGNALLEGATQLMGDNRTMTIHNGMQFSTFDRDNDNWNPGDPTKHCSREDAGGWWYNRCHAANPNGRYYWGGIYTKEQADYGTDDGVVWMNWKGSWYSMRQMAMKLRPKWP

Entity 3 polymer

描述 description	Fibrinogen gamma chain
分子量 formula_weight	37475.6 kDa
来源方法 src_method	nat
拷贝数 entity_count	4

聚合体 Polymer

聚合体类型 type	polypeptide(L)
链编号 strand_id	C,F,I,L

DSGQKTVQKILEEVRILEQIGVSHDAQIQELSEMWRVNQQFVTRLQQQLVDIRQTCSRPCQDTTANKISPITGKDCQQVVDNGGKDSGLYYIKPLKAKQPFLVFCEIENGNGWTVIQHRHDGSVNFTRDWVSYREGFGYLAPTLTTEFWLGNEKIHLLTGQQAYRLRIDLTDWENTHRYADYGHFKLTPESDEYRLFYSMYLDGDAGNAFDGFDFGDDPQDKFYTTHLGMLFSTPERDNDKYEGSCAEQDGSGWWMNRCHAGHLNGKYYFGGNYRKTDVEFPYDDGIIWATWHDRWYSLKMTTMKLLPMGRDLSGHGGQQQSK

Entity 4 polymer

描述 description	Peptide Ligand Gly-His-Arg-Pro-NH2
分子量 formula_weight	465.5 kDa
来源方法 src_method	syn
拷贝数 entity_count	4

聚合体 Polymer

聚合体类型 type	polypeptide(L)
链编号 strand_id	M,N,O,P

GHRPX

Entity 5 branched

描述 description	2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose
分子量 formula_weight	424.4 kDa
来源方法 src_method	man
拷贝数 entity_count	1

Entity 6 non-polymer

描述 description	2-acetamido-2-deoxy-alpha-D-glucopyranose
分子量 formula_weight	221.2 kDa
来源方法 src_method	man
拷贝数 entity_count	9

Entity 7 non-polymer

描述 description	alpha-D-mannopyranose
分子量 formula_weight	180.2 kDa
来源方法 src_method	man
拷贝数 entity_count	10

Entity 8 non-polymer

描述 description	CALCIUM ION
分子量 formula_weight	40.1 kDa
来源方法 src_method	syn
拷贝数 entity_count	8

Entity 9 non-polymer

描述 description	2-acetamido-2-deoxy-beta-D-glucopyranose
分子量 formula_weight	221.2 kDa
来源方法 src_method	man
拷贝数 entity_count	7

Entity 10 non-polymer

描述 description	beta-D-mannopyranose
分子量 formula_weight	180.2 kDa
来源方法 src_method	man
拷贝数 entity_count	2

Entity 11 non-polymer

描述 description	beta-D-galactopyranose
分子量 formula_weight	180.2 kDa
来源方法 src_method	man
拷贝数 entity_count	1

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6. 折叠分类 (SCOP + CATH) 48 domains

SCOP 2.08 (20 domains)

结构域编号 domain_id	d1lwua_
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwub1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwub2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwuc1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwuc2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwud_
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwue1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwue2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwuf1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwuf2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwug_
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwuh1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwuh2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwui1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwui2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwuj_
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwuk1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwuk2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

结构域编号 domain_id	d1lwul1
类 Class class	d — Alpha and beta proteins (a+b)
折叠类型 Fold fold	d.171 — Fibrinogen C-terminal domain-like
超家族 Superfamily superfamily	d.171.1 — Fibrinogen C-terminal domain-like
家族 Family family	d.171.1.1 — Fibrinogen C-terminal domain-like

结构域编号 domain_id	d1lwul2
类 Class class	h — Coiled coil proteins
折叠类型 Fold fold	h.1 — Parallel coiled-coil
超家族 Superfamily superfamily	h.1.8 — Fibrinogen coiled-coil and central regions
家族 Family family	h.1.8.1 — Fibrinogen coiled-coil and central regions

CATH v4.4 (28 domains)

结构域编号 domain_id	1lwuA00
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuB01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuB02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuB03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuC01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuC02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuC03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuD00
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuE01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuE02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuE03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuF01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuF02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuF03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuG00
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuH01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuH02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuH03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuI01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuI02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuI03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuJ00
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuK01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuK02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuK03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

结构域编号 domain_id	1lwuL01
类 Class class	3 — Alpha Beta
架构 Architecture architecture	90 — Alpha-Beta Complex
拓扑 Topology topology	215 — Gamma Fibrinogen; Chain A, domain 1
同源超家族 H-superfamily homologous superfamily	10 — Gamma Fibrinogen, chain A, domain 1

结构域编号 domain_id	1lwuL02
类 Class class	4 — Few Secondary Structures
架构 Architecture architecture	10 — Irregular
拓扑 Topology topology	530 — Gamma-fibrinogen Carboxyl Terminal Fragment; domain 2
同源超家族 H-superfamily homologous superfamily	10 — Gamma-fibrinogen Carboxyl Terminal Fragment, domain 2

结构域编号 domain_id	1lwuL03
类 Class class	1 — Mainly Alpha
架构 Architecture architecture	20 — Up-down Bundle
拓扑 Topology topology	5 — Single alpha-helices involved in coiled-coils or other helix-helix interfaces
同源超家族 H-superfamily homologous superfamily	50 —

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7. 引用文献 (1)

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晶胞边长 a length_a	76.735 Å
晶胞边长 b length_b	47.654 Å
晶胞边长 c length_c	244.650 Å
晶胞夹角 α angle_alpha	88.81 °
晶胞夹角 β angle_beta	97.23 °
晶胞夹角 γ angle_gamma	86.17 °
晶胞分子数 Z z_pdb	4

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

分辨率 resolution	2.800 Å
最低分辨率 resolution_low	20.000 Å
R 因子 r_factor	0.2510
R_work r_work	0.2450
R_free r_free	0.2870

Crystal structure of fragment D from lamprey fibrinogen complexed with the peptide Gly-His-Arg-Pro-amide

SAXS 散射曲线 SAXS Profile

P(r) 距离分布 P(r) Distribution

1. 结构基本信息 1. Structure Basics

2. SAXS 参数 (CRYSOL 理论计算) 2. SAXS Parameters (CRYSOL)

3. P(r) 距离分布 (GNOM 反演) 3. P(r) Analysis (GNOM)

4. 晶体学与实验 4. Crystallography & Experiment

晶胞参数 Unit Cell

对称性 Symmetry

精修参数 Refinement

衍射实验 Diffraction

5. 实体与聚合体信息 (11)

Entity 1 polymer

聚合体 Polymer

Entity 2 polymer

聚合体 Polymer

Entity 3 polymer

聚合体 Polymer

Entity 4 polymer

聚合体 Polymer

Entity 5 branched

Entity 6 non-polymer

Entity 7 non-polymer

Entity 8 non-polymer

Entity 9 non-polymer

Entity 10 non-polymer

Entity 11 non-polymer

6. 折叠分类 (SCOP + CATH) 48 domains

SCOP 2.08 (20 domains)

CATH v4.4 (28 domains)

7. 引用文献 (1)

8. 文件与曲线 (10)

Files (7)

Curves (3)

fit	/app/data/saxs_computation/lw/1lwu/1lwu.fit
pddf	/app/data/pr_computation/lw/1lwu/1lwu.pr.out
profile	/app/data/saxs_computation/lw/1lwu/1lwu.dat