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Bovine salivary protein form 30B with oleic acid

Analyse Bovine salivary protein form 30B with oleic acid in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6O1T
Type
protein
Length
378 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Short palate, lung and nasal epithelium carcinoma- associated protein 2B
UniProt
P79125
Ligands
OLA, CA
Pockets
5 · best druggability 0.75

Structure

x-ray diffraction · 2 distinct chains · 47% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AShort palate, lung and nasal epithelium carcinoma- associated protein 2Bprotein19246% helix, 30% strandP79125
BShort palate, lung and nasal epithelium carcinoma- associated protein 2Bprotein18647% helix, 31% strandP79125

Ligands and binding sites

  • OLA · Oleic acid · ligand · 2 copies · chains A, B
  • CA · Calcium ion · metal · 3 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11940.750.9029OLA
22940.710.8540empty
32060.690.8530OLA
41760.490.7725empty
5950.360.7518empty

Interfaces

1 interface between chains.

  • A–B · 799 Ų buried · 15 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6O1T · Bovine salivary protein form 30B with oleic acid · the same entry in another collection · chain A against A, TM-score 1.00
  • P79125 · AlphaFold monomer V2.0 prediction for short palate, lung and nasal epithelium… · a predicted model of the same protein · chain B against A, TM-score 0.99

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