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MolNFT v1 · #163306 · protein

Crystal structure of cysteinyl leukotriene receptor 1 in complex with pranlukast

6RZ4 · Cysteinyl leukotriene receptor 1,SOLUBLE cytochrome B562…: “Crystal structure of cysteinyl leukotriene receptor 1 in complex with pranlukast”. X-ray diffraction, 3 ligands (KNT, OLA, NA), 2 pockets (best druggability 0.82). MolNFT…

PDB
6RZ4
Type
protein
Length
395 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cysteinyl leukotriene receptor 1,SOLUBLE cytochrome B562, cysteinyl leukotriene receptor 1
UniProt
Q9Y271, P0ABE7
Ligands
KNT, OLA, NA
Pockets
2 · best druggability 0.82

Structure

x-ray diffraction · 1 distinct chain · 81% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACysteinyl leukotriene receptor 1,SOLUBLE cytochrome B562, cysteinyl leukotriene receptor 1protein39581% helix, 1% strandQ9Y271, P0ABE7

Ligands and binding sites

  • KNT · pranlukast · ligand · chains A
  • OLA · Oleic acid · ligand · chains A
  • NA · Sodium ion · metal · chains A
  • OLC · (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate · additive · 9 copies · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17220.820.8574KNT
23380.650.8047empty

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6RZ4 · Crystal structure of cysteinyl leukotriene receptor 1 in complex with pranlukast · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9Y271 · AlphaFold monomer V2.0 prediction for cysteinyl leukotriene receptor 1 (Q9Y271) · a predicted model of the same protein · chain A against A, TM-score 0.72
  • P0ABE7 · AlphaFold monomer V2.0 prediction for soluble cytochrome B562 (P0ABE7) · a predicted model of the same protein · chain A against A, TM-score 0.29

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