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MolNFT v1 · #61976 · protein

Structure and action of the myxobacterial chondrochloren halogenase cndh, a new variant of FAD-dependent halogenases

3E1T: “Structure and action of the myxobacterial chondrochloren halogenase cndh, a new variant of FAD-dependent…”. X-ray diffraction, 2 ligands (FAD, CL), 2 pockets (best druggability 0.80). MolNFT v1 #61976 on GenesisL1: 3D structure…

PDB
3E1T
Type
protein
Length
437 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Halogenase
Ligands
FAD, CL
Pockets
2 · best druggability 0.80

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHalogenaseprotein43732% helix, 25% strand—

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains A
  • CL · Chloride ion · ion · chains 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14160.800.8953CL, FAD
2670.370.7720empty

Compared structures

  • 3E1T · Structure and action of the myxobacterial chondrochloren halogenase CndH, a new variant… · the same entry in another collection · chain A against A, TM-score 1.00

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