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Ligand · SN3

SN3 · (R)-3-((2S,3R)-1-((2s,3ar,5s,6s,7as)-2-(2-(1-carbamimidoyl-2,5-dihydro-1H-pyrrol-3-yl)ethylcarbamoyl)-5,6-dihydroxyocta hydro-1H-indol-1-yl)-3-chloro-4-methyl-1-oxopentan-2-ylamino)-2-methoxy-3-oxopropyl hydrogen sulfate

SN3, (R)-3-((2S,3R)-1-((2s,3ar,5s,6s,7as)-2-(2-(1-carbamimidoyl-2,5-dihydro-1H-pyrrol-3-yl)ethylcarbamoyl)-5,6-dihydroxyocta hydro-1H-indol-1-yl)-3-chloro-4-methyl-1-oxopentan-2-ylamino)-2-methoxy-3-oxopropyl hydrogen sulfate (C26 H43 Cl…

Component
SN3
Formula
C26 H43 Cl N6 O10 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

SN3 in 2 structures; the first of them:

  • 2GDE · Thrombin in complex with inhibitor · SN3 H401 · binds HIS57, TYR60A, TRP60D, LEU99, ILE174, ASP189, ALA190, CYS191 and 12 more
  • 2GDE · Thrombin in complex with inhibitor · SN3 H401 · binds HIS57, TYR60A, TRP60D, LEU99, ILE174, ASP189, ALA190, CYS191 and 12 more

Residues it binds most

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

Found with

  • NA · Sodium ion

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