Structure of PDB 7wc9 Chain A Binding Site BS01

Receptor Information

>7wc9 Chain A (length=358) Species: 562,9606

LQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIAD
MLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTAKIWHLCAIS
LDRYVAIQNPSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSC
LLADDNFVLIGSFVSFFIPLTIMVITYFLTIKSLQKEAADLEDNWETLND
NLKVIEKADNAAQVKDALTKMRAAALDADILVGQIDDALKLANEGKVKEA
QAAAEQLKTTINAYIQKYGQSISNEQKACKVLGIVFFLFVVMWCPFFITN
IMAVICKESCNEDVIGALLNVFVWIGYLNSAVNPLVYTLFNKTYRSAFSR
YIQCQYKE

Ligand information

• Ligand ID: MG
• InChI: InChI=1S/Mg/q+2
• InChIKey: JLVVSXFLKOJNIY-UHFFFAOYSA-N
• SMILES:
  ACDLabs 10.04
  OpenEye OEToolkits 1.5.0: [Mg+2]
  CACTVS 3.341: [Mg++]
• Formula: Mg
• Name: MAGNESIUM ION
• DrugBank: DB01378
• PDB chain: 7wc9 Chain A Residue 1201

Receptor-Ligand Complex Structure

Structure summary

• PDB: 7wc9 Structure-based discovery of nonhallucinogenic psychedelic analogs.
• Resolution: 2.5 Å
• Binding residue (original residue number in PDB): E1008 D1012
• Binding residue (residue number reindexed from 1): E196 D200
• Annotation score: 4

Gene Ontology

Molecular Function

• GO:0004930 G protein-coupled receptor activity
• GO:0004993 G protein-coupled serotonin receptor activity
• GO:0005506 iron ion binding
• GO:0009055 electron transfer activity
• GO:0020037 heme binding

Biological Process

• GO:0007186 G protein-coupled receptor signaling pathway
• GO:0022900 electron transport chain

Cellular Component

• GO:0005886 plasma membrane
• GO:0016020 membrane

External links

• PDB: RCSB:7wc9, PDBe:7wc9, PDBj:7wc9
• PDBsum: 7wc9
• PubMed: 35084960
• UniProt: P0ABE7|C562_ECOLX Soluble cytochrome b562 (Gene Name=cybC);
  P28223|5HT2A_HUMAN 5-hydroxytryptamine receptor 2A (Gene Name=HTR2A)