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Ligand · 67O

67O · (2R,15R)-2-[(1-aminoisoquinolin-6-yl)amino]-8-fluoro-7-hydroxy-4,15,17-trimethyl-13-oxa-4,11-diazatricyclo[14.2.2.1~6,10~]henicosa-1(18),6(21),7,9,16,19-hexaene-3,12-dione

67O, (2R,15R)-2-[(1-aminoisoquinolin-6-yl)amino]-8-fluoro-7-hydroxy-4,15,17-trimethyl-13-oxa-4,11-diazatricyclo[14.2.2.1~6,10~]henicosa-1(18),6(21),7,9,16,19-hexaene-3,12-dione (C30 H30 F N5 O4, 543.6 g/mol), in the MolNFT structures on…

Component
67O
Formula
C30 H30 F N5 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

67O in 2 structures; the first of them:

  • 5I46 · Factor VIIA in complex with the inhibitor (2R,15R)-2-[(1-aminoisoquinolin-6-yl)amino]-8-fl… · 67O H301 · binds HIS57, ASP60, LYS60A, GLY97, THR98, THR99, ASP102, PRO170I and 14 more
  • 5I46 · Factor viia in complex with the inhibitor (2R,15R)-2-[(1… · 67O H301 · binds HIS57, ASP60, LYS60A, GLY97, THR98, THR99, ASP102, PRO170I and 14 more

Residues it binds most

GLY 2, ASP 2, SER 2, CYS 2, LYS 2, THR 2, VAL 2, GLN 2, HIS 2, PRO 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • SO4 · Sulfate ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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