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MolNFT v1 · #267923 · protein

AlphaFold monomer V2.0 prediction for npc intracellular cholesterol transporter 1 (O15118)

O15118: “AlphaFold monomer V2.0 prediction for npc intracellular cholesterol transporter 1 (O15118)”. 14 pockets (best druggability 0.84). MolNFT v1 #267923 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

Accession
O15118
Type
protein
Length
1,278 residues
Chains
1
Collection
MolNFT v1 / AlphaFold
Contract
0xBf7491af3407816DFa88a5EA4c82e8A2B1D721eD
Owner
0x22b7Fb1e0672534F7F94F5B4B1755D26b481FfA6
Molecule
Npc intracellular cholesterol transporter 1
UniProt
O15118
Pockets
14 · best druggability 0.84

Structure

1 distinct chain · 53% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANpc intracellular cholesterol transporter 1protein127853% helix, 11% strandO15118

Pockets

14 pockets found on a 1 Å grid, 7 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13420.840.9351empty
22490.810.9343empty
32150.780.9245empty
46350.740.8052empty
54150.730.8340empty

Modifications

Observed in the structure: 15 disulfide (disulfide).

Compared structures

  • 6W5U · NPC1 structure in gdn micelles at pH 5.5, conformation B · an experimental structure of the same protein · chain A against A, TM-score 0.88
  • 6W5R · NPC1 structure in nanodisc · an experimental structure of the same protein · chain A against A, TM-score 0.84
  • 6W5S · NPC1 structure in gdn micelles at pH 8.0 · an experimental structure of the same protein · chain A against A, TM-score 0.83
  • 6W5T · NPC1 structure in gdn micelles at pH 5.5, conformation a · an experimental structure of the same protein · chain A against A, TM-score 0.83
  • 6W5V · NPC1-NPC2 complex structure at pH 5.5 · an experimental structure of the same protein · chain A against A, TM-score 0.83
  • 6UOX · Structure of itraconazole-bound NPC1 · an experimental structure of the same protein · chain A against A, TM-score 0.80
  • 3JD8 · Cryo-EM structure of the full-length human NPC1 at 4.4 ångström · an experimental structure of the same protein · chain A against A, TM-score 0.76
  • 3JD8 · cryo-EM structure of the full-length human NPC1 at 4.4 angstrom · an experimental structure of the same protein · chain A against A, TM-score 0.76
  • 5JNX · The 6.6 A cryo-EM structure of the full-length human NPC1 in complex with the cleaved… · an experimental structure of the same protein · chain A against A, TM-score 0.76
  • 5JNX · The 6.6 a cryo-EM structure of the full-length human NPC1 in complex with the cleaved… · an experimental structure of the same protein · chain A against A, TM-score 0.76
  • 5U73 · Crystal structure of human niemann-pick C1 protein · an experimental structure of the same protein · chain A against A, TM-score 0.68
  • 5U74 · Structure of human niemann-pick C1 protein · an experimental structure of the same protein · chain A against A, TM-score 0.67

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