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MolNFT v1 · #34588 · protein

Crystal structure of class I chitinase from oryza sativa L. japonica

2DKV: “Crystal structure of class I chitinase from oryza sativa L. japonica”. X-ray diffraction, 1 pocket (best druggability 0.50). MolNFT v1 #34588 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2DKV
Type
protein
Length
286 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chitinase
EC
3.2.1.14
Pockets
1 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChitinase (EC 3.2.1.14)protein28640% helix, 4% strand—

Ligands and binding sites

  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 2 copies · chains A
  • MPD · (4S)-2-methyl-2,4-pentanediol · additive · 2 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12320.500.7536MES

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 2DKV · Crystal structure of class I chitinase from Oryza sativa L. japonica · the same entry in another collection · chain A against A, TM-score 1.00

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