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MolNFT v1 · #81506 · protein

Structure of the precursor of a thermostable variant of papain at 3.8 a resolution from a crystal soaked at pH 4

3USV: “Structure of the precursor of a thermostable variant of papain at 3.8 a resolution from a crystal soaked at…”. X-ray diffraction, 8 pockets (best druggability 0.81). MolNFT v1 #81506 on GenesisL1: 3D structure, binding sites and…

PDB
3USV
Type
protein
Length
616 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Papain
EC
3.4.22.2
UniProt
P00784
Pockets
8 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 16% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CPapain (EC 3.4.22.2)protein30816% helix, 4% strandP00784

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18830.810.84112empty
28850.800.82106empty
39280.790.82120empty
42840.600.7944empty
52280.570.7943empty

Interfaces

1 interface between chains.

  • A–C · 16 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3USV · Structure of the precursor of a thermostable variant of papain at 3.8 A resolution from a… · the same entry in another collection · chain A against A, TM-score 1.00
  • P00784 · AlphaFold monomer V2.0 prediction for papain (P00784) · a predicted model of the same protein · chain A against A, TM-score 0.91

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