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Ligand · YM5

YM5 · (3-{4-[(2S)-2-(aminomethyl)morpholin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}phenyl)methanol

YM5, (3-{4-[(2S)-2-(aminomethyl)morpholin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}phenyl)methanol (C18 H21 N5 O2, 339.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
YM5
Formula
C18 H21 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

YM5 in 2 structures; the first of them:

  • 2YM5 · Crystal structure of checkpoint kinase 1 (Chk1) in complex with inhibitors · YM5 A1271 · binds LEU15, GLY16, VAL23, ALA36, VAL68, LEU84, GLU85, TYR86 and 7 more
  • 2YM5 · Crystal structure of checkpoint kinase 1 (CHK1) in complex with inhibitors · YM5 A1271 · binds LEU15, GLY16, VAL23, ALA36, VAL68, LEU84, GLU85, TYR86 and 7 more

Residues it binds most

GLU 2, LEU 2, VAL 2, ALA 2, ASN 2, ASP 2, CYS 2, GLY 2, SER 2, TYR 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol

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