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Crystal structure of the type VI amidase immunity (TAI4) from agrobacterium tumefaciens

Analyse Crystal structure of the type VI amidase immunity (TAI4) from agrobacterium… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6IJE
Type
protein
Length
200 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TAI4
UniProt
A0A083ZID3
Pockets
2 · best druggability 0.38

Structure

x-ray diffraction · 2 distinct chains · 60% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BTAI4protein10060% helix, 4% strandA0A083ZID3
ATAI4protein10060% helix, 4% strandA0A083ZID3

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 7 copies · chains B, A

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

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1860.380.7620EDO
2830.360.7622EDO

Interfaces

1 interface between chains.

  • B–A · 1101 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6IJE · Crystal structure of the type VI amidase immunity (Tai4) from Agrobacterium tumefaciens · the same entry in another collection · chain B against B, TM-score 1.00

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