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MolNFT v1 · #56051 · protein

Crystal structure of chloride bound brassica juncea chitinase catalytic module (BJCHI3)

2Z38: “Crystal structure of chloride bound brassica juncea chitinase catalytic module (BJCHI3)”. X-ray diffraction, 1 ligand (CL), 1 pocket (best druggability 0.53). MolNFT v1 #56051 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
2Z38
Type
protein
Length
247 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chitinase
EC
3.2.1.14
UniProt
Q9SQF7
Ligands
CL
Pockets
1 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChitinase (EC 3.2.1.14)protein24745% helix, 2% strandQ9SQF7

Ligands and binding sites

  • CL · Chloride ion · ion · 12 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
12970.530.7540CL

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

  • 2Z38 · Crystal structure of chloride bound Brassica juncea chitinase catalytic module (Bjchi3) · the same entry in another collection · chain A against A, TM-score 1.00

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