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MolNFT v1 · #172107 · protein

Crystal structure of oxa-10LOOP48 in complex with hydrolyzed doripenem

6ZRG: “Crystal structure of oxa-10LOOP48 in complex with hydrolyzed doripenem”. X-ray diffraction, 3 ligands (QP2, SO4, CL). MolNFT v1 #172107 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ZRG
Type
protein
Length
484 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q7BNC2
Ligands
QP2, SO4, CL

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein242—Q7BNC2

Ligands and binding sites

  • QP2 · (2~{S},3~{R})-4-[(3~{S},5~{S})-5-[[[azanyl-bis(oxidanyl)methyl]amino]methyl]pyrrolidin-3-yl]sulfanyl-2-[(2~{S},3~{R})-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]-3-methyl-2,3-dihydro-1~{H}-pyrrole-5-carboxylic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B
  • CL · Chloride ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A, B

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

Compared structures

  • 6ZRG · Crystal structure of OXA-10loop48 in complex with hydrolyzed doripenem · the same entry in another collection · chain A against A, TM-score 1.00

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