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Ligand · OTX

OTX · 2-[(1~{R})-3-[bis(fluoranyl)methoxy]-1-[4-(3-methyl-1, 2,3-triazol-4-yl)pyrazol-1-yl]propyl]-5-[3-chloranyl-6-(4-chloranyl-1,2,3-triazol-1-yl)-2-fluoranyl-phenyl]-1-oxidanyl-pyridine

OTX, 2-[(1~{R})-3-[bis(fluoranyl)methoxy]-1-[4-(3-methyl-1, 2,3-triazol-4-yl)pyrazol-1-yl]propyl]-5-[3-chloranyl-6-(4-chloranyl-1,2,3-triazol-1-yl)-2-fluoranyl-phenyl]-1-oxidanyl-pyridine (C23 H18 Cl2 F3 N9 O2, 580.4 g/mol), in the MolNFT…

Component
OTX
Formula
C23 H18 Cl2 F3 N9 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

OTX in 2 structures; the first of them:

  • 7V18 · Factor XIa in Complex with Compound 3f · OTX A702 · binds ARG413, HIS414, LEU415, CYS416, HIS431, CYS432, TYR521, LEU524 and 17 more
  • 7V18 · Factor xia in complex with compound 3F · OTX A702 · binds ARG413, HIS414, LEU415, CYS416, HIS431, CYS432, TYR521, LEU524 and 17 more

Residues it binds most

CYS 2, GLY 2, ASP 2, HIS 2, LEU 2, SER 2, TYR 2, ALA 2, ARG 2, ILE 2 (residue and the binding sites it lines).

Found with

  • CIT · Citric acid

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