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Ligand · RFQ

RFQ · N-{3-[(1S)-2-(3-{(Z)-[amino(thiophen-2-yl)methylidene]amino}phenoxy)-1-hydroxyethyl]phenyl}thiophene-2-carboximidamide

RFQ, N-{3-[(1S)-2-(3-{(Z)-[amino(thiophen-2-yl)methylidene]amino}phenoxy)-1-hydroxyethyl]phenyl}thiophene-2-carboximidamide (C24 H21 N4 O2 S2, 461.6 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every…

Component
RFQ
Formula
C24 H21 N4 O2 S2
Class
ligand
Structures
6
PDB entries
3

Binding sites

RFQ in 6 structures; the first of them:

  • 4D3T · Structure of Bacillus subtilis Nitric Oxide Synthase in complex with… · RFQ A904 · binds HIS128, GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238 and 6 more
  • 4D3U · Structure of Bacillus subtilis Nitric Oxide Synthase H128S in complex with… · RFQ A904 · binds GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238, TYR239 and 5 more
  • 4D3V · Structure of Bacillus subtilis Nitric Oxide Synthase I218V in complex with… · RFQ A904 · binds HIS128, GLN129, PRO216, VAL218, PHE235, ASN236, GLY237, TRP238 and 7 more
  • 4D3T · Structure of bacillus subtilis nitric oxide synthase in complex with… · RFQ A904 · binds HIS128, GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238 and 6 more
  • 4D3U · Structure of bacillus subtilis nitric oxide synthase H128S in complex with… · RFQ A904 · binds GLN129, PRO216, ILE218, PHE235, ASN236, GLY237, TRP238, TYR239 and 5 more
  • 4D3V · Structure of bacillus subtilis nitric oxide synthase I218V in complex with… · RFQ A904 · binds HIS128, GLN129, PRO216, VAL218, PHE235, ASN236, GLY237, TRP238 and 7 more

Residues it binds most

TRP 6, ARG 6, ASN 6, GLN 6, GLU 6, GLY 6, MET 6, PHE 6, PRO 6, THR 6 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • CL · Chloride ion
  • GOL · Glycerol
  • POL · N-propanol

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