MolNFT v1 · #149916 · protein

Thermodynamic, crystallographic and computational studies of non mammalian fatty acid binding to bovine B-lactoglobulin

6GE7 · Beta-lactoglobulin: “Thermodynamic, crystallographic and computational studies of non mammalian fatty acid binding to bovine…”. X-ray diffraction, 1 ligand (EW8), 1 pocket (best druggability 0.71). MolNFT v1 #149916 on GenesisL1: 3D…

PDB: 6GE7
Type: protein
Length: 162 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Beta-lactoglobulin
UniProt: P02754
Ligands: EW8
Pockets: 1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 15% helix, 41% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Beta-lactoglobulin	protein	162	15% helix, 41% strand	P02754

Ligands and binding sites

EW8 · nonadecanoic acid · ligand · 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.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	250	0.71	0.85	38	EW8

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

6GE7 · Thermodynamic, Crystallographic and Computational Studies of Non Mammalian Fatty Acid… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt P02754
Elsewhere: RCSB PDB 6GE7 · PDBe 6GE7 · UniProt P02754

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