GL1X · GenesisL1 explorer

MolNFT v1 · #140951 · protein

Crystal structure of RAD5 and REV1

5YRQ · DNA repair protein RAD5,DNA repair protein REV1: “Crystal structure of RAD5 and REV1”. X-ray diffraction, 6 pockets (best druggability 0.70). MolNFT v1 #140951 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5YRQ
Type
protein
Length
489 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA repair protein RAD5,DNA repair protein REV1
EC
3.6.4.-, 2.7.7.-
UniProt
P32849, P12689
Pockets
6 · best druggability 0.70

Structure

x-ray diffraction · 4 distinct chains · 62% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA repair protein RAD5,DNA repair protein REV1 (EC 3.6.4.-, 2.7.7.-)protein12559% helix, 2% strandP32849, P12689
BDNA repair protein RAD5,DNA repair protein REV1 (EC 3.6.4.-, 2.7.7.-)protein12065% helix, 9% strandP32849, P12689
DDNA repair protein RAD5,DNA repair protein REV1 (EC 3.6.4.-, 2.7.7.-)protein12364% helix, 9% strandP32849, P12689
EDNA repair protein RAD5,DNA repair protein REV1 (EC 3.6.4.-, 2.7.7.-)protein12161% helix, 2% strandP32849, P12689

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15720.700.7964empty
21460.520.8026empty
31200.510.8022empty
4670.330.7615empty
5530.300.7613empty

Interfaces

6 interfaces between chains.

  • B–D · 1139 Ų buried · 29 hydrogen bonds · protein-protein
  • B–E · 1121 Ų buried · 15 hydrogen bonds · protein-protein
  • A–D · 1089 Ų buried · 16 hydrogen bonds · protein-protein
  • A–E · 813 Ų buried · 14 hydrogen bonds · protein-protein
  • A–B · 507 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5YRQ · Crystal structure of Rad5 and Rev1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P12689 · AlphaFold monomer V2.0 prediction for DNA repair protein REV1 (P12689) · a predicted model of the same protein · chain B against A, TM-score 0.75
  • P32849 · AlphaFold monomer V2.0 prediction for DNA repair protein RAD5 (P32849) · a predicted model of the same protein · chain D against A, TM-score 0.41

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