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MolNFT v1 · #14708 · protein

Non-specific lipid transfer protein 1 from barley in complex with L-alfa-lysophosphatidylcholine, laudoyl

1MID · Nonspecific lipid-transfer protein 1: “Non-specific lipid transfer protein 1 from barley in complex with L-alfa-lysophosphatidylcholine, laudoyl”. X-ray diffraction, 1 ligand (LAP), 1 pocket (best druggability 0.81). MolNFT v1…

PDB
1MID
Type
protein
Length
91 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Nonspecific lipid-transfer protein 1
UniProt
P07597
Ligands
LAP
Pockets
1 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 63% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANonspecific lipid-transfer protein 1protein9163% helix, 0% strandP07597

Ligands and binding sites

  • LAP · [2-((1-oxododecanoxy-(2-hydroxy-3-propanyl))-phosphonate-oxy)-ethyl]-trimethylammonium · ligand · 3 copies · 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.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13690.810.8937LAP

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1MID · Non-specific lipid transfer protein 1 from barley in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P07597 · AlphaFold monomer V2.0 prediction for non-specific lipid-transfer protein 1 (P07597) · a predicted model of the same protein · chain A against A, TM-score 0.95

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