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The structure of miab with pentasulfide bridge

Analyse The structure of miab with pentasulfide bridge in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7MJZ
Type
protein
Length
444 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TRNA-2-methylthio-N(6)-dimethylallyladenosine synthase
EC
2.8.4.3
UniProt
A0A174GYG1
Ligands
SF4, PS5, NA
Pockets
2 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATRNA-2-methylthio-N(6)-dimethylallyladenosine synthase (EC 2.8.4.3)protein44438% helix, 24% strandA0A174GYG1

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · 2 copies · chains A
  • PS5 · Pentasulfide-sulfur · ligand · chains A
  • NA · Sodium ion · metal · 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
16130.770.8355SF4, PS5
2610.310.7614empty

Compared structures

  • 7MJZ · The structure of MiaB with pentasulfide bridge · the same entry in another collection · chain A against A, TM-score 1.00

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