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MolNFT v2 · #222135 · protein

Cryo-EM map of human clmap-clamp loader ATAD5-RFC-gapped PCNA complex in intermediate state 3

8UI7 · ATPase family AAA domain-containing protein 5: “Cryo-EM map of human clmap-clamp loader ATAD5-RFC-gapped PCNA complex in intermediate state 3”. Electron microscopy at 4.2, 3 ligands (AGS, ADP, MG), 20 pockets (best druggability…

PDB
8UI7
Type
protein
Length
2,760 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
4.2
Source
Homo sapiens
Molecule
ATPase family AAA domain-containing protein 5; Replication factor C subunit 2…
UniProt
Q96QE3, P35250, P40937, P35249, P40938, P12004
Ligands
AGS, ADP, MG
Pockets
20 · best druggability 0.88

Structure

electron microscopy · resolution 4.2 · 6 distinct chains · 50% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AATPase family AAA domain-containing protein 5protein64347% helix, 6% strandQ96QE3
BReplication factor C subunit 2protein31961% helix, 8% strandP35250
CReplication factor C subunit 5protein33958% helix, 8% strandP40937
DReplication factor C subunit 4protein32858% helix, 7% strandP35249
EReplication factor C subunit 3protein34858% helix, 11% strandP40938
F, G, HProliferating cell nuclear antigenprotein26118% helix, 41% strandP12004

Ligands and binding sites

  • AGS · Phosphothiophosphoric acid-adenylate ester · ligand · 3 copies · chains A, B, C
  • ADP · Adenosine-5'-diphosphate · ligand · 2 copies · chains D, E
  • MG · Magnesium ion · metal · 3 copies · chains A, B, C

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

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110960.880.89123MG, AGS
210130.860.87112empty
311460.850.85145MG, AGS
46410.840.8878MG, AGS
51510.820.9739empty

Interfaces

16 interfaces between chains.

  • A–B · 4347 Ų buried · 38 hydrogen bonds · protein-protein
  • A–E · 3950 Ų buried · 42 hydrogen bonds · protein-protein
  • B–C · 2132 Ų buried · 23 hydrogen bonds · protein-protein
  • D–E · 1868 Ų buried · 31 hydrogen bonds · protein-protein
  • C–D · 1679 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • P40938 · AlphaFold monomer V2.0 prediction for replication factor C subunit 3 (P40938) · a predicted model of the same protein · chain E against A, TM-score 0.98
  • P40937 · AlphaFold monomer V2.0 prediction for replication factor C subunit 5 (P40937) · a predicted model of the same protein · chain C against A, TM-score 0.88
  • Q96QE3 · AlphaFold monomer V2.0 prediction for ATPase family aaa domain- containing protein 5… · a predicted model of the same protein · chain A against A, TM-score 0.72

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