GL1X · GenesisL1 explorer

MolNFT v1 · #179816 · protein

Structure of pqs response protein pqse in complex with 4-(3-(2-methyl- 2-MORPHOLINOBUTYL)UREIDO)-N-(thiazol-2-YL)BENZAMIDE

7KGX: “Structure of pqs response protein pqse in complex with 4-(3-(2-methyl…”. X-ray diffraction, 2 ligands (WE1, FE). MolNFT v1 #179816 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7KGX
Type
protein
Length
300 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P20581
Ligands
WE1, FE

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein300—P20581

Ligands and binding sites

  • WE1 · 4-({[(2R)-2-methyl-2-(morpholin-4-yl) butyl]carbamoyl}amino)-N-(1,3-thiazol-2-yl)benzamide · ligand · chains A
  • FE · Fe (III) ion · metal · 2 copies · chains A

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

Compared structures

  • 7KGX · Structure of PQS Response Protein PqsE in Complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P20581 · AlphaFold monomer V2.0 prediction for 2-aminobenzoylacetyl-CoA thioesterase (P20581) · a predicted model of the same protein · chain A against A, TM-score 0.99

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