Structure of PDB 7s4l Chain F Binding Site BS01

Receptor Information

>7s4l Chain F (length=239) Species: 1091494 (Methylotuvimicrobium alcaliphilum 20Z)

SAVRSRAEAVKVSRTFDYMILFTVFFVVLGGYHIHYMLTGGDWDFWTDWK
DRRLWVTVAPIVSITFPAAVQAVLWWRYRIAWGATLCVLGLLLGEWINRY
FNFWGWTYFPVNFVFPSNLMPGAIVLDVILMLSNSMTLTAVVGGLAWGLL
FYPGNWPIIAPLHVPVEYNGMMMTLADLQGYHYVRTGTPEYIRMVEKGTL
RTFGKDVAPVSAFFSGFVSILIYFLWHFFGSWFGSEKFV

Ligand information

• Ligand ID: 6ER
• InChI: InChI=1S/C20H41NO8P/c1-6-8-10-12-19(22)26-16-18(29-20(23)13-11-9-7-2)17-28-30(24,25)27-15-14-21(3,4)5/h18,24H,6-17H2,1-5H3/t18-/m0/s1
• InChIKey: ZQODAMILHYQXDS-SFHVURJKSA-N
• SMILES:
  CACTVS 3.385: CCCCCC(=O)OC[CH](CO[P]([OH-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCC
  CACTVS 3.385: CCCCCC(=O)OC[C@@H](CO[P]([OH-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCC
  OpenEye OEToolkits 2.0.5: CCCCCC(=O)OCC(COP(=O)([OH-])OCC[N+](C)(C)C)OC(=O)CCCCC
  OpenEye OEToolkits 2.0.5: CCCCCC(=O)OC[C@@H](COP(=O)([OH-])OCC[N+](C)(C)C)OC(=O)CCCCC
• Formula: C20 H41 N O8 P
• Name: (S)-2,3-bis(hexanoyloxy)propyl(2-(trimethylammonio)ethyl)phosphate
• PDB chain: 7s4l Chain I Residue 304

Receptor-Ligand Complex Structure

Structure summary

• PDB: 7s4l Recovery of particulate methane monooxygenase structure and activity in a lipid bilayer.
• Resolution: 2.46 Å
• Binding residue (original residue number in PDB): V63 M199
• Binding residue (residue number reindexed from 1): V58 M194
• Annotation score: 1

Enzymatic activity

• Enzyme Commision number: 1.14.13.25: methane monooxygenase (soluble).

Gene Ontology

Molecular Function

• GO:0004497 monooxygenase activity
• GO:0015049 methane monooxygenase [NAD(P)H] activity

Cellular Component

• GO:0016020 membrane

External links

• PDB: RCSB:7s4l, PDBe:7s4l, PDBj:7s4l
• PDBsum: 7s4l
• PubMed: 35298269
• UniProt: G4SZ63