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MolNFT v1 · #180741 · protein

Crystal structure of a putative deoxyhypusine synthase from entamoeba histolytica

7L9R · Deoxyhypusine synthase, putative: “Crystal structure of a putative deoxyhypusine synthase from entamoeba histolytica”. X-ray diffraction, 1 ligand (CL), 4 pockets (best druggability 0.74). MolNFT v1 #180741 on GenesisL1: 3D…

PDB
7L9R
Type
protein
Length
562 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Deoxyhypusine synthase, putative
UniProt
C4LXB8
Ligands
CL
Pockets
4 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADeoxyhypusine synthase, putativeprotein27650% helix, 13% strandC4LXB8
BDeoxyhypusine synthase, putativeprotein28647% helix, 14% strandC4LXB8

Ligands and binding sites

  • CL · Chloride ion · ion · 2 copies · chains A, B

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
16640.740.8078empty
21010.370.7520CL
3880.350.7517CL
4510.270.7416empty

Interfaces

1 interface between chains.

  • A–B · 1016 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7L9R · Crystal Structure of a putative deoxyhypusine synthase from Entamoeba histolytica · the same entry in another collection · chain A against A, TM-score 1.00

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