GL1X · GenesisL1 explorer

Ligand · V0G

V0G · N-(3-{[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino}phenyl)-4-{[4-(dimethylamino) butanoyl]amino}benzamide

V0G, N-(3-{[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino}phenyl)-4-{[4-(dimethylamino) butanoyl]amino}benzamide (C31 H30 Cl N7 O2, 568.1 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding…

Component
V0G
Formula
C31 H30 Cl N7 O2
Class
ligand
Structures
3
PDB entries
2

Binding sites

V0G in 3 structures; the first of them:

  • 6XD3 · Structure of the human CAK in complex with THZ1 · V0G J401 · binds LEU18, VAL26, ALA39, ILE75, PHE91, PHE93, MET94, GLU95 and 6 more
  • 8ORM · Cryo-EM structure of CAK-THZ1 · V0G J401 · binds LEU18, GLY19, GLU20, GLY21, VAL26, ALA39, LYS41, PHE91 and 10 more
  • 6XD3 · Structure of the human cak in complex with THZ1 · V0G J401 · binds LEU18, VAL26, ALA39, ILE75, PHE91, PHE93, MET94, GLU95 and 6 more

Residues it binds most

LEU 3, PHE 3, ASP 3, GLU 3, ALA 3, ASN 3, CYS 3, MET 3, PRO 3, THR 3 (residue and the binding sites it lines).

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