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Ligand · QNC

QNC · quinoline-2-carboxylic acid

QNC, quinoline-2-carboxylic acid (C10 H7 N O2, 173.2 g/mol), in the MolNFT structures on GenesisL1: bound in 10 records (6 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
QNC
Formula
C10 H7 N O2
Class
ligand
Structures
10
PDB entries
6

Binding sites

QNC in 10 structures; the first of them:

  • 2FGU · X-ray crystal structure of HIV-1 Protease T80S variant in complex with the inhibitor… · QNC A504 · binds GLY27, ALA28, ASP29, GLY48, GLY49, ASN505, HPH506, ARG8 and 1 more
  • 2FGV · X-ray crystal structure of HIV-1 Protease T80N variant in complex with the inhibitor… · QNC A508 · binds GLY27, ALA28, ASP29, GLY48, GLY49, PHE53, ASN509, HPH510 and 2 more
  • 4JKU · Crystal structure of probable sugar kinase protein from Rhizobium etli CFN 42 complexed… · QNC A501 · binds SER188, PHE189, ASP192, ARG195, LEU218, SER219, GLN222, THR223
  • 7X6J · SARS-CoV-2 3CL protease (3CLpro) in complex with compound 3af · QNC A401 · binds LEU27, PRO39, HIS41, CYS145, GLY146, HIS163, HIS164, MET165 and 3 more
  • 9DL3 · Structure of proline utilization A complexed with quinoline-2-carboxylic acid · QNC A2003 · binds ASP762, GLY763, ARG764, GLU785, VAL786, LEU789
  • 1MTB · Viability of a drug-resistant HIV-1 protease mutant: structural insights for better… · QNC A100 · binds GLY27, ALA28, ASP29, GLY48, GLY49, PHE53, ASN101, HPH102 and 2 more
  • 2FGU · X-ray crystal structure of HIV-1 protease T80S variant in complex with the inhibitor… · QNC A504 · binds GLY27, ALA28, ASP29, GLY48, GLY49, ASN505, HPH506, ARG8 and 1 more
  • 2FGV · X-ray crystal structure of HIV-1 protease T80N variant in complex with the inhibitor… · QNC A508 · binds GLY27, ALA28, ASP29, GLY48, GLY49, PHE53, ASN509, HPH510 and 2 more
  • 4JKU · Crystal structure of probable sugar kinase protein from rhizobium etli cfn 42 complexed… · QNC A501 · binds SER188, PHE189, ASP192, ARG195, LEU218, SER219, GLN222, THR223
  • 7X6J · SARS-cov-2 3CL protease (3CLPRO) in complex with compound 3AF · QNC A401 · binds LEU27, PRO39, HIS41, CYS145, HIS163, HIS164, MET165, ASP187

Residues it binds most

GLY 10, ASP 14, ARG 12, LEU 9, PRO 8, SER 4, ALA 7, HIS 3, PHE 7, ASN 5 (residue and the binding sites it lines).

Found with

  • DIQ · 2-methyl-decahydro-isoquinoline-3-carboxylic acid
  • NTB · Tertiary-butylamine
  • PO4 · Phosphate ion
  • ADN · Adenosine
  • DMS · Dimethyl sulfoxide
  • FAD · Flavin-adenine dinucleotide
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • FMT · Formic acid
  • PEG · Di(hydroxyethyl)ether
  • PG4 · Tetraethylene glycol
  • PGE · Triethylene glycol

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