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Ligand · H0O

H0O · ~{N}-[4-[3,5-dimethyl-4-(5-methyl-2~{H}-indazol-4-yl) pyrazol-1-yl]phenyl]propanamide

H0O, ~{N}-[4-[3,5-dimethyl-4-(5-methyl-2~{H}-indazol-4-yl) pyrazol-1-yl]phenyl]propanamide (C22 H23 N5 O, 373.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
H0O
Formula
C22 H23 N5 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

H0O in 2 structures; the first of them:

  • 7R0Q · KRasG12C in complex with GDP and compound 3 · H0O A1003 · binds VAL9, GLY10, ALA11, CYS12, GLY13, LYS16, PRO34, THR58 and 15 more
  • 7R0Q · KRASG12C in complex with GDP and compound 3 · H0O A1003 · binds VAL9, GLY10, ALA11, CYS12, GLY13, LYS16, PRO34, THR58 and 15 more

Residues it binds most

GLY 4, ALA 4, ARG 4, GLN 4, TYR 4, VAL 4, GLU 4, ASP 4, CYS 4, HIS 4 (residue and the binding sites it lines).

Found with

  • GDP · Guanosine-5'-diphosphate
  • MG · Magnesium ion

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