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RFC:PCNA bound to dsdna with a ssdna gap of six nucleotides

Analyse RFC:PCNA bound to dsdna with a ssdna gap of six nucleotides in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7U1A
Type
protein + DNA
Length
2,759 residues
Chains
11
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Replication factor C subunit 1; Replication factor C subunit 4; Replication factor C…
UniProt
P38630, P40339, P38629, P40348, P38251, P15873
Ligands
AGS, ADP, MG
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 11 distinct chains · 46% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AReplication factor C subunit 1protein61754% helix, 9% strandP38630
BReplication factor C subunit 4protein31961% helix, 10% strandP40339
CReplication factor C subunit 3protein32757% helix, 8% strandP38629
DReplication factor C subunit 2protein34060% helix, 8% strandP40348
EReplication factor C subunit 5protein33755% helix, 13% strandP38251
FProliferating cell nuclear antigenprotein25516% helix, 45% strandP15873
GProliferating cell nuclear antigenprotein25717% helix, 44% strandP15873
HProliferating cell nuclear antigenprotein25316% helix, 45% strandP15873
IDNA - primerdna15——
JDNA - templatedna30——
KDNA - non primerdna9——

Ligands and binding sites

  • AGS · Phosphothiophosphoric acid-adenylate ester · ligand · 3 copies · chains A, B, C, D, E
  • ADP · Adenosine-5'-diphosphate · ligand · 2 copies · chains B, C, A, E
  • MG · Magnesium ion · metal · 4 copies · chains A, B, C, D, E

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
18930.870.89105empty
27510.840.8798empty
32500.830.9549ADP, MG
44460.820.9059empty
51740.810.9734AGS, MG

Interfaces

30 interfaces between chains.

  • A–E · 2966 Ų buried · 35 hydrogen bonds · protein-protein
  • D–E · 2895 Ų buried · 41 hydrogen bonds · protein-protein
  • B–C · 2734 Ų buried · 34 hydrogen bonds · protein-protein
  • C–D · 2552 Ų buried · 36 hydrogen bonds · protein-protein
  • A–B · 2543 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 7U1A · RFC:PCNA bound to dsDNA with a ssDNA gap of six nucleotides · the same entry in another collection · chain K against K, TM-score 1.00
  • P38251 · AlphaFold monomer V2.0 prediction for replication factor C subunit 5 (P38251) · a predicted model of the same protein · chain E against A, TM-score 0.96

Analyse

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