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The 1.43 ångström crystal structure of bacteriorhodopsin crystallized from bicelles

Analyse The 1.43 ångström crystal structure of bacteriorhodopsin crystallized from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4Y9H
Type
protein
Length
226 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bacteriorhodopsin
UniProt
B0R5N9
Ligands
D12, D10, RET, HP6, R16, PO4
Pockets
1 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 78% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABacteriorhodopsinprotein22678% helix, 5% strandB0R5N9

Ligands and binding sites

  • D12 · Dodecane · ligand · 8 copies · chains A
  • D10 · Decane · ligand · 4 copies · chains A
  • RET · Retinal · ligand · chains A
  • HP6 · Heptane · ligand
  • R16 · Hexadecane · ligand · chains A
  • PO4 · Phosphate ion · ion · chains A
  • DD9 · nonane · additive · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11180.800.9820RET

Modifications

Observed in the structure: 1 cofactor (retinal Schiff base).

Compared structures

  • 4Y9H · The 1.43 angstrom crystal structure of bacteriorhodopsin crystallized from bicelles · the same entry in another collection · chain A against A, TM-score 1.00

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