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MolNFT v1 · #191325 · protein

Crystal structure of human MYT1 kinase domain bounded with compound 28

8D6C: “Crystal structure of human MYT1 kinase domain bounded with compound 28”. X-ray diffraction, 2 ligands (QGR, SO4). MolNFT v1 #191325 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
8D6C
Type
protein
Length
555 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q99640
Ligands
QGR, SO4

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein276—Q99640
B—protein279—Q99640

Ligands and binding sites

  • QGR · (1P)-2-amino-6-bromo-1-(3-hydroxy-2,6-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide · ligand · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · 4 copies · chains A, B
  • GOL · Glycerol · additive · chains B

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

Compared structures

  • 8D6C · Crystal Structure of Human Myt1 Kinase domain Bounded with compound 28 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q99640 · AlphaFold monomer V2.0 prediction for membrane-associated tyrosine- and… · a predicted model of the same protein · chain B against A, TM-score 0.98

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