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MolNFT v1 · #48567 · protein

The intrinsic affinity between E2 and the cys domain of E1 in ubiquitin-like modifications

2PX9 · Sumo-activating enzyme subunit 2: “The intrinsic affinity between E2 and the cys domain of E1 in ubiquitin-like modifications”. Solution nmr, 3 pockets (best druggability 0.74). MolNFT v1 #48567 on GenesisL1: 3D structure, binding…

PDB
2PX9
Type
protein
Length
375 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Sumo-activating enzyme subunit 2; Sumo-conjugating enzyme UBC9
EC
6.3.2.-
UniProt
Q9UBT2, P63279
Pockets
3 · best druggability 0.74

Structure

solution nmr · 2 distinct chains · 42% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASumo-activating enzyme subunit 2 (EC 6.3.2.-)protein21747% helix, 0% strandQ9UBT2
BSumo-conjugating enzyme UBC9 (EC 6.3.2.-)protein15834% helix, 16% strandP63279

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18430.740.7877empty
21430.440.7626empty
3720.360.7721empty

Interfaces

1 interface between chains.

  • A–B · 782 Ų buried · 18 hydrogen bonds · protein-protein

Compared structures

  • 2PX9 · The intrinsic affinity between E2 and the Cys domain of E1 in Ubiquitin-like modifications · the same entry in another collection · chain A against A, TM-score 1.00
  • P63279 · AlphaFold monomer V2.0 prediction for sumo-conjugating enzyme UBC9 (P63279) · a predicted model of the same protein · chain B against A, TM-score 0.98
  • Q9UBT2 · AlphaFold monomer V2.0 prediction for sumo-activating enzyme subunit 2 (Q9UBT2) · a predicted model of the same protein · chain A against A, TM-score 0.84

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