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MolNFT v1 · #143017 · protein

Crystal structure of the DNA polymerase III subunit beta from pseudomonas aeruginosa

6AMS · Beta sliding clamp: “Crystal structure of the DNA polymerase III subunit beta from pseudomonas aeruginosa”. X-ray diffraction, 1 ligand (PO4), 17 pockets (best druggability 0.72). MolNFT v1 #143017 on GenesisL1: 3D structure…

PDB
6AMS
Type
protein
Length
1,456 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta sliding clamp
UniProt
Q9I7C4
Ligands
PO4
Pockets
17 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 22% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta sliding clampprotein36322% helix, 43% strandQ9I7C4
BBeta sliding clampprotein36322% helix, 43% strandQ9I7C4
CBeta sliding clampprotein36422% helix, 43% strandQ9I7C4
DBeta sliding clampprotein36622% helix, 43% strandQ9I7C4

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 4 copies · chains A, B, C, D

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

Pockets

17 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1540.720.9820empty
26770.670.7670empty
35710.640.7647empty
4630.580.8915empty
52290.560.7934empty

Interfaces

4 interfaces between chains.

  • A–B · 1308 Ų buried · 25 hydrogen bonds · protein-protein
  • C–D · 1286 Ų buried · 22 hydrogen bonds · protein-protein
  • A–C · 831 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 751 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 6AMS · Crystal structure of the DNA polymerase III subunit beta from Pseudomonas aeruginosa · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9I7C4 · AlphaFold monomer V2.0 prediction for beta sliding clamp (Q9I7C4) · a predicted model of the same protein · chain D against A, TM-score 0.97

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