GL1X · GenesisL1 explorer

MolNFT v1 · #57291 · protein

UBCH5B~UBIQUITIN conjugate

3A33 · Ubiquitin-conjugating enzyme E2 D2: “UBCH5B~UBIQUITIN conjugate”. X-ray diffraction, 1 pocket (best druggability 0.59). MolNFT v1 #57291 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3A33
Type
protein
Length
226 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin-conjugating enzyme E2 D2; Ubiquitin
EC
6.3.2.19
UniProt
P62837, P62988
Pockets
1 · best druggability 0.59

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUbiquitin-conjugating enzyme E2 D2 (EC 6.3.2.19)protein15037% helix, 18% strandP62837
BUbiquitinprotein7624% helix, 33% strandP62988

Ligands and binding sites

  • GOL · Glycerol · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12030.590.8132GOL

Interfaces

1 interface between chains.

  • A–B · 479 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 3A33 · UbcH5b~Ubiquitin Conjugate · the same entry in another collection · chain A against A, TM-score 1.00
  • P62837 · AlphaFold monomer V2.0 prediction for ubiquitin-conjugating enzyme E2 D2 (P62837) · a predicted model of the same protein · chain A against A, TM-score 0.97

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