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MolNFT v1 · #155805 · protein

Crystal structure of ndm-1 in complex with D-captopril derivative WSS04145

6LJ5: “Crystal structure of ndm-1 in complex with D-captopril derivative WSS04145”. X-ray diffraction, 2 ligands (EF0, ZN). MolNFT v1 #155805 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6LJ5
Type
protein
Length
229 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
C7C422
Ligands
EF0, ZN

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein229—C7C422

Ligands and binding sites

  • EF0 · 1-[(2S)-2-methyl-3-sulfanyl-propanoyl]piperidine-4-carboxylic acid · ligand · chains A
  • ZN · Zinc ion · metal · 2 copies · 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

  • 6LJ5 · Crystal structure of NDM-1 in complex with D-captopril derivative wss04145 · the same entry in another collection · chain A against A, TM-score 1.00
  • C7C422 · AlphaFold monomer V2.0 prediction for metallo-beta-lactamase type 2 (C7C422) · a predicted model of the same protein · chain A against A, TM-score 1.00

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