GL1X · GenesisL1 explorer

MolNFT v1 · #163579 · protein

Crystal structure of CARM1 in complex with inhibitor AA175

6S7A: “Crystal structure of CARM1 in complex with inhibitor AA175”. X-ray diffraction, 1 ligand (KY5). MolNFT v1 #163579 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6S7A
Type
protein
Length
1,368 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q86X55
Ligands
KY5

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D—protein342—Q86X55

Ligands and binding sites

  • KY5 · (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[3-azanylpropyl-[3-(pyridin-2-ylamino) propyl]amino]methyl]oxolane-3,4-diol · ligand · 4 copies · chains A, B, C, D
  • GOL · Glycerol · additive · 6 copies · chains A, B, C, D

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

Compared structures

  • 6S7A · Crystal structure of CARM1 in complex with inhibitor AA175 · the same entry in another collection · chain D against D, TM-score 1.00
  • Q86X55 · AlphaFold monomer V2.0 prediction for histone-arginine methyltransferase CARM1 (Q86X55) · a predicted model of the same protein · chain B against A, TM-score 1.00

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