Ligand · COC

COC · Cocaine

COC, Cocaine (C17 H21 N O4, 303.4 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component: COC
Formula: C17 H21 N O4
Class: ligand
Structures: 3
PDB entries: 3

Binding sites

COC in 3 structures; the first of them:

4XP4 · X-ray structure of Drosophila dopamine transporter in complex with cocaine · COC A706 · binds PHE43, ALA44, ASP46, ALA48, ALA117, VAL120, ASP121, TYR123 and 9 more
8DE3 · Native serotonin transporter in complex with 15B8 Fab antibody in the presence of cocaine · COC A1004 · binds TYR132, ALA133, ASP135, ASN138, ALA206, ILE209, ALA210, TYR212 and 11 more
9EO4 · Outward-open structure of human dopamine transporter bound to cocaine · COC B707 · binds PHE76, ALA77, ASP79, ASN82, SER149, VAL152, GLY153, PHE155 and 8 more

Residues it binds most

PHE 3, ALA 3, SER 3, GLY 3, TYR 3, ASP 3, VAL 3, ASN 2, LEU 2, THR 1 (residue and the binding sites it lines).

Found with

Y01 · Cholesterol hemisuccinate
NA · Sodium ion
CL · Chloride ion
CLR · Cholesterol
P4G · 1-ethoxy-2-(2-ethoxyethoxy)ethane
GLC · alpha-D-glucopyranose
NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
LMT · Dodecyl-beta-D-maltoside

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