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MolNFT v1 · #67282 · protein

Crystal structure of the haloferax volcanii proliferating cell nuclear antigen

3IFV · PCNA: “Crystal structure of the haloferax volcanii proliferating cell nuclear antigen”. X-ray diffraction, 1 ligand (NA), 1 pocket (best druggability 0.59). MolNFT v1 #67282 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
3IFV
Type
protein
Length
690 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PCNA
UniProt
D0VWY8
Ligands
NA
Pockets
1 · best druggability 0.59

Structure

x-ray diffraction · 3 distinct chains · 24% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APCNAprotein21625% helix, 43% strandD0VWY8
BPCNAprotein23423% helix, 45% strandD0VWY8
CPCNAprotein24023% helix, 46% strandD0VWY8

Ligands and binding sites

  • NA · Sodium ion · metal · 9 copies · chains A, B, C

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1800.590.8719empty

Interfaces

3 interfaces between chains.

  • B–C · 641 Ų buried · 9 hydrogen bonds · protein-protein
  • A–C · 637 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 577 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 3IFV · Crystal structure of the Haloferax volcanii proliferating cell nuclear antigen · the same entry in another collection · chain A against A, TM-score 1.00

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