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MolNFT v1 · #8675 · protein

Schiff-base complex of yeast 5-aminolaevulinic acid dehydratase with 4-keto-5-amino-hexanoic (kah) at 1.64 a resolution

1H7P: “Schiff-base complex of yeast 5-aminolaevulinic acid dehydratase with 4-keto-5-amino-hexanoic (kah) at 1.64 a…”. X-ray diffraction, 2 ligands (KAH, ZN), 4 pockets (best druggability 0.65). MolNFT v1 #8675 on GenesisL1: 3D structure…

PDB
1H7P
Type
protein
Length
340 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5-aminolaevulinic acid dehydratase
EC
4.2.1.24
UniProt
P05373
Ligands
KAH, ZN
Pockets
4 · best druggability 0.65

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A5-aminolaevulinic acid dehydratase (EC 4.2.1.24)protein34040% helix, 17% strandP05373

Ligands and binding sites

  • KAH · 5-amino-4-hydroxyhexanoic acid · ligand · chains A
  • ZN · Zinc ion · metal · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1860.650.9126KAH
2600.360.7713empty
3930.360.7520empty
4540.270.7414empty

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 1H7P · Schiff-base complex of yeast 5-aminolaevulinic acid dehydratase with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P05373 · AlphaFold monomer V2.0 prediction for delta-aminolevulinic acid dehydratase (P05373) · a predicted model of the same protein · chain A against A, TM-score 0.98

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