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MolNFT v1 · #160909 · protein

Class D beta-lactamase in complex with beta-lactam antibiotic

6PXX: “Class D beta-lactamase in complex with beta-lactam antibiotic”. X-ray diffraction, 2 ligands (5R7, CL). MolNFT v1 #160909 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6PXX
Type
protein
Length
486 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q6XEC0
Ligands
5R7, CL

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein242—Q6XEC0
B—protein244—Q6XEC0

Ligands and binding sites

  • 5R7 · (2~{S},3~{R})-3-methyl-2-[(2~{S},3~{R})-3-oxidanyl-1-oxidanylidene-butan-2-yl]-4-[(3~{S},5~{S})-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl]sulfanyl-3,4-dihydro-2~{H}-pyrrole-5-carboxylic acid · ligand · 2 copies · chains A, B
  • CL · Chloride ion · ion · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 5 copies · chains A, B
  • EPE · 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid · additive · chains B

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

Compared structures

  • 6PXX · Class D beta-lactamase in complex with beta-lactam antibiotic · the same entry in another collection · chain A against A, TM-score 1.00

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