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MolNFT v1 · #189531 · protein

Human alkb homolog ALKBH6 in complex with tris and ni

7VJS · Alpha-ketoglutarate-dependent dioxygenase alkb homolog 6: “Human alkb homolog ALKBH6 in complex with tris and ni”. X-ray diffraction, 1 ligand (NI), 1 pocket (best druggability 0.61). MolNFT v1 #189531 on GenesisL1: 3D structure…

PDB
7VJS
Type
protein
Length
205 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Alpha-ketoglutarate-dependent dioxygenase alkb homolog 6
EC
1.14.11.-
UniProt
Q3KRA9
Ligands
NI
Pockets
1 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 20% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAlpha-ketoglutarate-dependent dioxygenase alkb homolog 6 (EC 1.14.11.-)protein20520% helix, 33% strandQ3KRA9

Ligands and binding sites

  • NI · Nickel (II) ion · metal · chains A
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11500.610.8425NI, TRS

Compared structures

  • 7VJS · Human AlkB homolog ALKBH6 in complex with Tris and Ni · the same entry in another collection · chain A against A, TM-score 1.00
  • Q3KRA9 · AlphaFold monomer V2.0 prediction for alpha-ketoglutarate-dependent dioxygenase alkb… · a predicted model of the same protein · chain A against A, TM-score 0.96

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