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MolNFT v1 · #139047 · protein

Leukotriene B4 receptor BLT1 in complex with BIIL260

5X33 · LTB4 RECEPTOR,LYSOZYME,LTB4 receptor: “Leukotriene B4 receptor BLT1 in complex with BIIL260”. X-ray diffraction, 1 ligand (7Y9), 3 pockets (best druggability 0.80). MolNFT v1 #139047 on GenesisL1: 3D structure, binding sites and…

PDB
5X33
Type
protein
Length
439 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
LTB4 RECEPTOR,LYSOZYME,LTB4 receptor
EC
3.2.1.17
UniProt
Q9WTK1, A0A097J792
Ligands
7Y9
Pockets
3 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 69% helix, 5% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALTB4 RECEPTOR,LYSOZYME,LTB4 receptor (EC 3.2.1.17)protein43969% helix, 5% strandQ9WTK1, A0A097J792

Ligands and binding sites

  • 7Y9 · 4-[[3-[[4-[2-(4-hydroxyphenyl)propan-2-yl]phenoxy]methyl]phenyl]methoxy]benzenecarboximidamid E · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14250.800.88477Y9
25370.680.7854empty
3820.330.7418empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 5X33 · Leukotriene B4 receptor BLT1 in complex with BIIL260 · the same entry in another collection · chain A against A, TM-score 1.00

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