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MolNFT v1 · #25381 · protein

Crystal structure of a degv lipid binding protein (TM1468) from thermotoga maritima at 2.45 a resolution

1VPV · UPF0230 protein TM1468: “Crystal structure of a degv lipid binding protein (TM1468) from thermotoga maritima at 2.45 a resolution”. X-ray diffraction, 2 ligands (PLM, PO4), 5 pockets (best druggability 0.77). MolNFT v1 #25381 on…

PDB
1VPV
Type
protein
Length
560 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
UPF0230 protein TM1468
UniProt
Q9X1H9
Ligands
PLM, PO4
Pockets
5 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 39% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUPF0230 protein TM1468protein28238% helix, 28% strandQ9X1H9
BUPF0230 protein TM1468protein27840% helix, 29% strandQ9X1H9

Ligands and binding sites

  • PLM · Palmitic acid · ligand · 2 copies · chains A, B
  • PO4 · Phosphate ion · ion · 2 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, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11320.770.9530PLM
21270.770.9530PLM
37670.770.8164PO4
41450.520.8024empty
51190.470.7919empty

Interfaces

1 interface between chains.

  • A–B · 749 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 modified (engineered).

Compared structures

  • 1VPV · Crystal structure of a degv lipid binding protein (tm1468) from thermotoga maritima at… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9X1H9 · AlphaFold monomer V2.0 prediction for fatty acid-binding protein TM_1468 (Q9X1H9) · a predicted model of the same protein · chain A against A, TM-score 0.99

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