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MolNFT v1 · #53244 · protein

Clavulanic acid biosynthesis oligopeptide binding protein 2 complexed with arginine

2WOP: “Clavulanic acid biosynthesis oligopeptide binding protein 2 complexed with arginine”. X-ray diffraction, 1 ligand (ARG), 3 pockets (best druggability 0.77). MolNFT v1 #53244 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
2WOP
Type
protein
Length
554 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Clavulanic acid biosynthesis oligopeptide binding protein 2
UniProt
Q8KRB4
Ligands
ARG
Pockets
3 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 31% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AClavulanic acid biosynthesis oligopeptide binding protein 2protein55431% helix, 19% strandQ8KRB4

Ligands and binding sites

  • ARG · Arginine · ligand · chains A
  • GOL · Glycerol · additive · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

3 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110270.770.7996ARG, GOL, ACT
21520.470.7730empty
3720.370.7723empty

Compared structures

  • 2WOP · Clavulanic acid biosynthesis oligopeptide binding protein 2 complexed with arginine · the same entry in another collection · chain A against A, TM-score 1.00

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