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MolNFT v1 · #26042 · protein

Crystal structure of uroporphyrinogen III synthase from an extremely thermophilic bacterium thermus thermophilus HB8 (wild type, native, form-2 crystal)

1WD7: “Crystal structure of uroporphyrinogen III synthase from an extremely thermophilic bacterium thermus…”. X-ray diffraction, 4 pockets (best druggability 0.71). MolNFT v1 #26042 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
1WD7
Type
protein
Length
509 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uroporphyrinogen III synthase
EC
4.2.1.75
UniProt
Q5SKH2
Pockets
4 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 46% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUroporphyrinogen III synthase (EC 4.2.1.75)protein25446% helix, 19% strandQ5SKH2
BUroporphyrinogen III synthase (EC 4.2.1.75)protein25545% helix, 19% strandQ5SKH2

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17220.710.7862empty
23260.600.7738empty
3850.420.7915empty
4640.360.7815empty

Interfaces

1 interface between chains.

  • A–B · 640 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 1WD7 · Crystal Structure of Uroporphyrinogen III Synthase from an Extremely Thermophilic… · the same entry in another collection · chain A against A, TM-score 1.00

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