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MolNFT v1 · #29602 · protein

Ubiquitin-conjugating enzyme E2S

1ZDN: “Ubiquitin-conjugating enzyme E2S”. X-ray diffraction, 1 ligand (NA), 1 pocket (best druggability 0.55). MolNFT v1 #29602 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1ZDN
Type
protein
Length
298 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ubiquitin-conjugating enzyme E2S
EC
6.3.2.19
UniProt
Q16763
Ligands
NA
Pockets
1 · best druggability 0.55

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUbiquitin-conjugating enzyme E2S (EC 6.3.2.19)protein15140% helix, 17% strandQ16763
BUbiquitin-conjugating enzyme E2S (EC 6.3.2.19)protein14740% helix, 17% strandQ16763

Ligands and binding sites

  • NA · Sodium ion · metal · 2 copies · 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
11820.550.7926empty

Interfaces

1 interface between chains.

  • A–B · 1152 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1ZDN · Ubiquitin-conjugating enzyme E2S · the same entry in another collection · chain A against A, TM-score 1.00
  • Q16763 · AlphaFold monomer V2.0 prediction for ubiquitin-conjugating enzyme E2 S (Q16763) · a predicted model of the same protein · chain A against A, TM-score 0.99

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