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MolNFT v1 · #33890 · protein

Crystal structure of thioesterase superfamily MEMBER2 from mus musculus

2CY9 · Thioesterase superfamily member 2: “Crystal structure of thioesterase superfamily MEMBER2 from mus musculus”. X-ray diffraction, 1 pocket (best druggability 0.43). MolNFT v1 #33890 on GenesisL1: 3D structure, binding sites and…

PDB
2CY9
Type
protein
Length
255 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Thioesterase superfamily member 2
EC
3.1.2.-
UniProt
Q9CQR4
Pockets
1 · best druggability 0.43

Structure

x-ray diffraction · 2 distinct chains · 18% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AThioesterase superfamily member 2 (EC 3.1.2.-)protein12210% helix, 40% strandQ9CQR4
BThioesterase superfamily member 2 (EC 3.1.2.-)protein13325% helix, 36% strandQ9CQR4

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1760.430.8016empty

Interfaces

1 interface between chains.

  • A–B · 632 Ų buried · 10 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 modified (engineered).

Compared structures

  • 2CY9 · Crystal structure of thioesterase superfamily member2 from Mus musculus · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9CQR4 · AlphaFold monomer V2.0 prediction for acyl-coenzyme a thioesterase 13 (Q9CQR4) · a predicted model of the same protein · chain B against A, TM-score 0.97

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