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MolNFT v1 · #143316 · protein

Crystal structure of zea mays acyl-protein thioesterase 2

6AVY: “Crystal structure of zea mays acyl-protein thioesterase 2”. X-ray diffraction, 5 pockets (best druggability 0.66). MolNFT v1 #143316 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6AVY
Type
protein
Length
463 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Acyl-protein thioesterase 2
UniProt
B6T1C9
Pockets
5 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAcyl-protein thioesterase 2protein23135% helix, 21% strandB6T1C9
BAcyl-protein thioesterase 2protein23237% helix, 21% strandB6T1C9

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12790.660.8231empty
24140.600.7663empty
3730.520.8520empty
41120.490.8017empty
5610.370.7813empty

Interfaces

1 interface between chains.

  • A–B · 694 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 6AVY · Crystal structure of Zea mays acyl-protein thioesterase 2 · the same entry in another collection · chain A against A, TM-score 1.00

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