Ligand · HEX
HEX · Hexane
HEX, Hexane (C6 H14, 86.2 g/mol), in the MolNFT structures on GenesisL1: bound in 83 records (64 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.
- Component
- HEX
- Formula
- C6 H14
- Class
- additive
- Structures
- 83
- PDB entries
- 64
Binding sites
HEX in 83 structures; the first of them:
- 5I71 · X-ray structure of the ts3 human serotonin transporter complexed with s-citalopram at the… · HEX A705 · binds ILE576, TYR579, ALA580, THR583
- 5I74 · X-ray structure of the ts3 human serotonin transporter complexed with Br-citalopram at… · HEX A704 · binds TYR579, ALA580
- 6EUQ · MdfA(Q131R/L339E) · HEX A511 · binds TRP70, LEU205, LEU208, GLY209, TYR212, MET355
- 6LM0 · The crystal structure of cyanorhodopsin (CyR) N2098R from cyanobacteria Calothrix sp.… · HEX A302 · binds GLU38, LYS95, ALA98
- 6LPK · A2AR crystallized in EROCOC17+4, LCP-SFX at 293 K · HEX A2408
- 6LPL · A2AR crystallized in EROCOC17+4, SS-ROX at 100 K · HEX A2408
- 6Q4N · Fusidic acid bound AcrB_V340A · HEX B1114 · binds ALA451, VAL454, PRO455, PHE458, LEU876
- 6Q4O · Fusidic acid bound AcrB_I27A · HEX A1112 · binds ALA457, PHE458, ARG468
- 6TT9 · rTBL Recombinant Lectin From Tepary Bean · HEX AAA311 · binds SER69, PHE70, ALA71, TYR169, ALA231
- 6V37 · K2P2.1(TREK-1)I110D:RuR:ML335 bound channel structure · HEX B901 · binds LEU164, CYS219
- 6V3C · K2P2.1(TREK-1)I110D:Ru360 bound channel structure · HEX B407 · binds GLY154
- 6WU1 · Structure of apo LaINDY · HEX A501
- 6WU2 · Structure of the LaINDY-malate complex · HEX A501 · binds LEU16, GLY19, ILE20, TRP23, ALA46, LEU64, VAL68
Residues it binds most
ILE 148, LEU 116, PHE 94, TYR 85, ALA 71, TRP 74, VAL 52, SER 45, MET 35, ARG 33 (residue and the binding sites it lines).
Found with
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