GL1X · GenesisL1 explorer

MolNFT v1 · #169833 · protein

Structure of SUMO1-ML00752641 adduct bound to sae

6XOI: “Structure of SUMO1-ML00752641 adduct bound to sae”. X-ray diffraction, 3 ligands (VBA, ZN, SO4). MolNFT v1 #169833 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6XOI
Type
protein
Length
755 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9UBE0, Q9UBT2, P63165
Ligands
VBA, ZN, SO4

Structure

x-ray diffraction · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein311—Q9UBE0
B—protein403—Q9UBT2
C—protein41—P63165

Ligands and binding sites

  • VBA · [(1R,2R,3S,4R)-4-{[5-(1-benzyl-1H-pyrazole-3-carbonyl) pyrimidin-4-yl]amino}-2,3-dihydroxycyclopentyl]methyl sulfamate · ligand · chains B, C
  • ZN · Zinc ion · metal · chains B
  • SO4 · Sulfate ion · ion · chains A, B

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

Compared structures

  • 6XOI · Structure of SUMO1-ML00752641 adduct bound to SAE · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UBT2 · AlphaFold monomer V2.0 prediction for sumo-activating enzyme subunit 2 (Q9UBT2) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q9UBE0 · AlphaFold monomer V2.0 prediction for sumo-activating enzyme subunit 1 (Q9UBE0) · a predicted model of the same protein · chain A against A, TM-score 0.98

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