7ama

IL-17A in complex with small molecule modulators

Method: X-RAY DIFFRACTION Dmax: 64.9 Å Quality: REASONABLE

1. Protein Identity and Related Structures Protein Identity & Related Structures

Interleukin-17A

Homo sapiens

UniProt Q16552

State in the Current Structure

Assembly Oligomeric State Construct Mutations and Modifications Ligands, Ions and Associated Components Method and Experimental Conditions Structure Quality
1 Protein homooligomer Homooligomer Protein × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain A; UniProt 42–150 Chain B; UniProt 42–150 Not recorded RMK ~{N}-[(2~{S})-1,1-dicyclopropyl-3-[[4-(3,5-dimethyl-1~{H}-pyrazol-4-yl)phenyl]amino]-3-oxidanylidene-propan-2-yl]-2-propan-2-yl-pyrazole-3-carboxamide × 1 X-RAY DIFFRACTION X-ray crystallization conditions:VAPOR DIFFUSION, SITTING DROP;293 K;PEG 10 000, isopropanol, sodium citrate Resolution 2.48 Å R-free 0.255

Other States of the Same Protein in the Database

Each row is a biological assembly of the same UniProt protein in another PDB entry. The “Difference from current entry” column identifies evidence-level differences; no tag means the currently parsed fields agree.

43 other PDB entries and 56 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name IL17_HUMAN
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–109; UniProt 42–150 Author chain B; PDBConstruct 1–109; UniProt 42–150

The page prioritizes protein identity, the current assembly, associated components, oligomeric state and cross-PDB links. Chain mapping and sequence ranges are retained as data evidence. Internal IDs, import timestamps and assembly operation expressions are maintenance fields and are not shown here.

SAXS scattering curve SAXS Profile

SAXS profile for 7ama

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 7ama
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2. Structure Basics 2. Structure Basics

Entry ID entry_id7ama
Deposition date deposition_date2020-10-08
Structure title titleIL-17A in complex with small molecule modulators
Keywords keywordsinterleukin IL-17A inhibitor receptor, IMMUNE SYSTEM; IMMUNE SYSTEM
Experimental Method methodX-RAY DIFFRACTION

3. SAXS Parameters (CRYSOL theoretical calculation) 3. SAXS Parameters (CRYSOL)

Radius of gyration Rg (Guinier) rg_guinier20.28
Radius of gyration Rg (electron density) rg_electron19.28
Forward intensity I(0) i010422700.00
Molecular weight molecular_weight23240.0 kDa
Excluded volume excluded_volume28740 ų
Envelope volume envelope_volume34438 ų
Hydration-shell volume shell_volume15818 ų
Envelope diameter envelope_diameter63.6
Shell Rg shell_rg24.26
Envelope Rg envelope_rg19.40
Shape Rg shape_rg19.26
Total Rg total_rg20.07
Total atoms total_atoms1631
Residues n_residues197
Spherical-harmonic order n_harmonics20
q range q_range— – 0.5000 −1
Data points n_points101
Shell type shell_typedirectional
Solvent electron density solvent_density0.3340 e/ų
Shell contrast contrast_shell0.0300 e/ų
CRYSOL version crysol_version4.1.3

4. P(r) Distance Distribution (GNOM inversion) 4. P(r) Analysis (GNOM)

Maximum dimension Dmax dmax64.9
Rg (real space) rg_real20.34
Rg uncertainty (real space) rg_real_error0.59
I(0) (real space) i0_real1.0420e+07
I(0) uncertainty (real space) i0_real_error1.3790e+05
Rg (reciprocal space) rg_reciprocal20.33
I(0) (reciprocal space) i0_reciprocal10420000.0000
Solution quality estimate total_estimate0.7482
Solution quality rating solution_quality REASONABLE a REASONABLE solution
P(r) peaks n_peaks5
Primary peak position r_peak_primary20.4
Skewness Skewness skewness0.372
Kurtosis Kurtosis kurtosis-0.483
Angular range angular_range— – 0.3900 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha1512000.0000
Real-space data points n_real_points71
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.681; Stabil: 0.907; Sysdev: 1.000; Positv: 1.000; Valcen: 0.957; Smooth: 0.000

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (3)

8. Citations (1)

9. Files and Curves (10)