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MolNFT v1 · #60515 · protein

Structure of human cytosolic X-prolyl aminopeptidase

3CTZ · Xaa-pro aminopeptidase 1: “Structure of human cytosolic X-prolyl aminopeptidase”. X-ray diffraction, 3 ligands (MN, CA, NA), 5 pockets (best druggability 0.67). MolNFT v1 #60515 on GenesisL1: 3D structure, binding sites and pockets…

PDB
3CTZ
Type
protein
Length
617 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Xaa-pro aminopeptidase 1
EC
3.4.11.9
UniProt
Q9NQW7
Ligands
MN, CA, NA
Pockets
5 · best druggability 0.67

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AXaa-pro aminopeptidase 1 (EC 3.4.11.9)protein61740% helix, 20% strandQ9NQW7

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • CA · Calcium ion · metal · chains A
  • NA · Sodium ion · metal · chains A
  • P6G · Hexaethylene glycol · additive · chains A

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

Pockets

5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16410.670.7762MN, NA, P6G
22330.550.7729empty
31960.430.7331empty
4520.350.7816empty
5600.310.7517empty

Compared structures

  • 3CTZ · Structure of human cytosolic X-prolyl aminopeptidase · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NQW7 · AlphaFold monomer V2.0 prediction for xaa-pro aminopeptidase 1 (Q9NQW7) · a predicted model of the same protein · chain A against A, TM-score 0.97

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