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MolNFT v1 · #172709 · protein

Crystal structure of mertk kinase domain in complex with UNC2025

7AB2: “Crystal structure of mertk kinase domain in complex with UNC2025”. X-ray diffraction, 2 ligands (R6N, CL). MolNFT v1 #172709 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7AB2
Type
protein
Length
270 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q12866
Ligands
R6N, CL

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein270—Q12866

Ligands and binding sites

  • R6N · 4-[2-(butylamino)-5-[4-[(4-methylpiperazin-1-yl) methyl]phenyl]pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexan-1-ol · ligand · chains A
  • CL · Chloride ion · ion · 4 copies · chains A
  • DMS · Dimethyl sulfoxide · additive · 2 copies · chains A

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

Compared structures

  • 7AB2 · Crystal structure of MerTK kinase domain in complex with UNC2025 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q12866 · AlphaFold monomer V2.0 prediction for tyrosine-protein kinase mer (Q12866) · a predicted model of the same protein · chain A against A, TM-score 0.93

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