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MolNFT v1 · #105475 · protein

Structure of RAD6~UB

4R62 · Ubiquitin-conjugating enzyme E2 2: “Structure of RAD6~UB”. X-ray diffraction, 1 pocket (best druggability 0.38). MolNFT v1 #105475 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4R62
Type
protein
Length
227 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin-conjugating enzyme E2 2; Ubiquitin-40S ribosomal protein S27A
EC
6.3.2.19
UniProt
P06104, P62979
Pockets
1 · best druggability 0.38

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUbiquitin-conjugating enzyme E2 2 (EC 6.3.2.19)protein14938% helix, 20% strandP06104
BUbiquitin-40S ribosomal protein S27Aprotein7823% helix, 36% strandP62979

Ligands and binding sites

  • ACT · Acetate ion · additive · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11090.380.7525empty

Interfaces

1 interface between chains.

  • A–B · 254 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 isopeptide (isopeptide).

Compared structures

  • 4R62 · Structure of Rad6~Ub · the same entry in another collection · chain A against A, TM-score 1.00
  • P06104 · AlphaFold monomer V2.0 prediction for ubiquitin-conjugating enzyme E2 2 (P06104) · a predicted model of the same protein · chain A against A, TM-score 0.99

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