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Ligand · T9H

T9H · 2-fluoranyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-4-ylamino)propan-2-yl]-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)benzamide

T9H, 2-fluoranyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-4-ylamino)propan-2-yl]-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)benzamide (C31 H29 F N6 O4 S2, 632.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
T9H
Formula
C31 H29 F N6 O4 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

T9H in 2 structures; the first of them:

  • 4COH · Crystal structure of Trypanosoma cruzi CYP51 bound to the sulfonamide derivative of the… · T9H A1460 · binds ILE45, PHE48, ILE72, TYR103, ILE105, MET106, PHE110, TYR116 and 14 more
  • 4COH · Crystal structure of trypanosoma cruzi CYP51 bound to the sulfonamide derivative of the… · T9H A1460 · binds ILE45, PHE48, ILE72, TYR103, ILE105, MET106, PHE110, TYR116 and 14 more

Residues it binds most

MET 4, PHE 4, ALA 4, ILE 4, TYR 4, VAL 4, CYS 4, LEU 4, PRO 4, THR 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe

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