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Ligand · TCR

TCR · Cyclomethyltryptophan

TCR, Cyclomethyltryptophan (C12 H12 N2 O2, 216.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (6 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
TCR
Formula
C12 H12 N2 O2
Class
ligand
Structures
6
PDB entries
6

Binding sites

TCR in 6 structures; the first of them:

  • 7SIL · Structure of positive allosteric modulator-bound active human calcium-sensing receptor · TCR A904 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 6 more
  • 7SIM · Structure of positive allosteric modulator-free active human calcium-sensing receptor · TCR A902 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 6 more
  • 9ASB · Structure of human calcium-sensing receptor in complex with chimeric Gq (miniGisq)… · TCR Q1004 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 6 more
  • 9AVG · Structure of human calcium-sensing receptor in complex with chimeric Gs (miniGis) protein… · TCR Q1004 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 6 more
  • 9AVL · Structure of human calcium-sensing receptor in complex with Gi3 protein in nanodiscs · TCR Q1002 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 6 more
  • 9AYF · Structure of human calcium-sensing receptor in complex with Gi1 (miniGi1) protein in… · TCR Q1004 · binds ARG66, TRP70, THR145, GLY146, SER147, ALA168, SER169, SER170 and 5 more

Residues it binds most

SER 12, ALA 12, ILE 12, ARG 12, GLU 12, GLY 12, THR 12, TRP 12, TYR 12 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • PO4 · Phosphate ion
  • 9IG · 3-(2-chlorophenyl)-N-[(1R)-1-(3-methoxyphenyl) ethyl]propan-1-amine
  • A1AF7 · (19R,22S,25R)-22,25,26-trihydroxy-16,22-dioxo-17,21,23-trioxa-22lambda~5~-phosphahexacosan-19-yl (9Z)-octadec-9-enoate
  • Y01 · Cholesterol hemisuccinate
  • CLR · Cholesterol
  • AV0 · 2-decyl-2-{[(4-O-alpha-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]methyl}dodecyl 4-O-alpha-D-glucopyranosyl-beta-D-glucopyranoside

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