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MolNFT v2 · #162458 · protein

Crystal structure of PBP2a from MRSA in complex with piperacillin and quinazoli

6Q9N: “Crystal structure of PBP2a from MRSA in complex with piperacillin and quinazoli”. X-ray diffraction at 2.5, 4 ligands (QLN, MUR, CD). MolNFT v2 #162458 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6Q9N
Type
protein
Length
1,276 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.5
Source
Staphylococcus aureus (strain Mu50 / ATCC 700699)
UniProt
A0A0H3JPA5
Ligands
QLN, MUR, CD, CL

Structure

x-ray diffraction · resolution 2.5 · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein639—A0A0H3JPA5
B—protein637—A0A0H3JPA5

Ligands and binding sites

  • QLN · 3-[2-[(~{E})-2-(4-ethynylphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]benzoic acid · ligand · chains A, B
  • MUR · beta-muramic acid · sugar · chains A
  • CD · Cadmium ion · metal · 4 copies · chains A, B
  • CL · Chloride ion · ion · 4 copies · chains A, B

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

Compared structures

  • 6Q9N · Crystal structure of PBP2A from mrsa in complex with piperacillin and quinazolinone · the same entry in another collection · chain A against A, TM-score 1.00

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