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MolNFT v1 · #114276 · protein

Structures and functional analysis of periplasmic 5- METHYLTHIOADENOSINE/S-adenosylhomocysteine nucleosidase from aeromonas hydrophila

5B7P · MTA/SAH nucleosidase: “Structures and functional analysis of periplasmic 5- METHYLTHIOADENOSINE/S-adenosylhomocysteine nucleosidase…”. X-ray diffraction, 1 ligand (MTA), 2 pockets (best druggability 0.66). MolNFT v1 #114276 on…

PDB
5B7P
Type
protein
Length
495 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MTA/SAH nucleosidase
EC
3.2.2.16, 3.2.2.9
UniProt
A0KGU9
Ligands
MTA
Pockets
2 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 35% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMTA/SAH nucleosidase (EC 3.2.2.16, 3.2.2.9)protein24835% helix, 34% strandA0KGU9
BMTA/SAH nucleosidase (EC 3.2.2.16, 3.2.2.9)protein24735% helix, 34% strandA0KGU9

Ligands and binding sites

  • MTA · 5'-deoxy-5'-methylthioadenosine · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11220.660.8925MTA
21000.610.8719MTA

Interfaces

1 interface between chains.

  • A–B · 2540 Ų buried · 38 hydrogen bonds · protein-protein

Compared structures

  • 5B7P · Structures and functional analysis of periplasmic… · the same entry in another collection · chain A against A, TM-score 1.00

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