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Crystal structure of CRY78AA

Analyse Crystal structure of CRY78AA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7Y79
Type
protein
Length
383 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Toxin
UniProt
A0A3S6Q0Y2
Pockets
3 · best druggability 0.61

Structure

x-ray diffraction · 2 distinct chains · 18% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AToxinprotein18819% helix, 45% strandA0A3S6Q0Y2
BToxinprotein19518% helix, 44% strandA0A3S6Q0Y2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14910.610.7550empty
22160.520.7726empty
31790.480.7627empty

Interfaces

1 interface between chains.

  • A–B · 601 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 7Y79 · Crystal structure of Cry78Aa · the same entry in another collection · chain A against A, TM-score 1.00

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