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MolNFT v2 · #132625 · protein

PanDDA analysis group deposition -- Crystal Structure of Kalirin/Rac1 in complex with MolPort-009-178-994

5QQI: “PanDDA analysis group deposition -- Crystal Structure of Kalirin/Rac1 in complex with MolPort-009-178-994”. X-ray diffraction at 2.08, 1 ligand (N6D). MolNFT v2 #132625 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5QQI
Type
protein
Length
356 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.08
Source
Homo sapiens
UniProt
P63000, O60229
Ligands
N6D

Structure

x-ray diffraction · resolution 2.08 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein177—P63000
B—protein179—O60229

Ligands and binding sites

  • N6D · N-[3-(methoxymethyl)phenyl]-N'-(5-methyl-1,2-oxazol-3-yl)urea · ligand · chains A
  • EDO · 1,2-ethanediol · additive · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 5QQI · Pandda analysis group deposition -- crystal structure of KALIRIN/RAC1 in complex with… · the same entry in another collection · chain A against A, TM-score 1.00

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