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MolNFT v1 · #146934 · protein

Crystal structure of chalcone synthase from selaginella moellendorffii - hydrogen peroxide treated

6DXF: “Crystal structure of chalcone synthase from selaginella moellendorffii - hydrogen peroxide treated”. X-ray diffraction, 7 pockets (best druggability 0.79). MolNFT v1 #146934 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
6DXF
Type
protein
Length
757 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Chalcone synthase
UniProt
D8S128
Pockets
7 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 44% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AChalcone synthaseprotein37844% helix, 24% strandD8S128
BChalcone synthaseprotein37944% helix, 23% strandD8S128

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14050.790.8757empty
24050.780.8758empty
3660.740.9921empty
4580.710.9821empty
51990.540.7839empty

Interfaces

1 interface between chains.

  • A–B · 2282 Ų buried · 50 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (oxidation).

Compared structures

  • 6DXF · Crystal structure of chalcone synthase from Selaginella moellendorffii - hydrogen… · the same entry in another collection · chain A against A, TM-score 1.00

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