GL1X · GenesisL1 explorer

MolNFT v2 · #156821 · protein

Crystal structure of NDM-1 in complex with D-captopril derivative wss0218

6LIP: “Crystal structure of NDM-1 in complex with D-captopril derivative wss0218”. X-ray diffraction at 0.98, 2 ligands (EEL, ZN). MolNFT v2 #156821 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6LIP
Type
protein
Length
229 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
0.98
Source
Klebsiella pneumoniae
UniProt
C7C422
Ligands
EEL, ZN

Structure

x-ray diffraction · resolution 0.98 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein229—C7C422

Ligands and binding sites

  • EEL · (2R)-1-[3-sulfanyl-2-(sulfanylmethyl) propanoyl]pyrrolidine-2-carboxylic acid · ligand · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A

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

Compared structures

  • 6LIP · Crystal structure of ndm-1 in complex with D-captopril derivative WSS0218 · 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 0.99

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