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MolNFT v1 · #161521 · protein

The structure of schizosaccharomyces pombe PCNA in complex with an SPD1 derived peptide

6QH1 · Proliferating cell nuclear antigen: “The structure of schizosaccharomyces pombe PCNA in complex with an SPD1 derived peptide”. X-ray diffraction, 8 pockets (best druggability 0.75). MolNFT v1 #161521 on GenesisL1: 3D structure…

PDB
6QH1
Type
protein
Length
746 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Proliferating cell nuclear antigen; S-phase delaying protein 1
UniProt
Q03392, Q10585
Pockets
8 · best druggability 0.75

Structure

x-ray diffraction · 4 distinct chains · 20% helix, 46% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProliferating cell nuclear antigenprotein24320% helix, 47% strandQ03392
BProliferating cell nuclear antigenprotein25120% helix, 47% strandQ03392
CProliferating cell nuclear antigenprotein24220% helix, 46% strandQ03392
DS-phase delaying protein 1protein1040% helix, 0% strandQ10585

Pockets

8 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1570.750.9920empty
2550.740.9818empty
3980.500.8216empty
41220.440.7719empty
51200.410.7629empty

Interfaces

4 interfaces between chains.

  • B–C · 794 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 710 Ų buried · 14 hydrogen bonds · protein-protein
  • A–C · 662 Ų buried · 10 hydrogen bonds · protein-protein
  • C–D · 500 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 6QH1 · The structure of Schizosaccharomyces pombe PCNA in complex with an Spd1 derived peptide · the same entry in another collection · chain D against D, TM-score 1.00
  • Q03392 · AlphaFold monomer V2.0 prediction for proliferating cell nuclear antigen (Q03392) · a predicted model of the same protein · chain A against A, TM-score 0.99
  • Q10585 · AlphaFold monomer V2.0 prediction for S-phase delaying protein 1 (Q10585) · a predicted model of the same protein · chain D against A, TM-score 0.37

Analyse

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