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Co-crystal structure of M. tuberculosis iles T-box in complex with tRNA-3'-oh

Analyse Co-crystal structure of M. tuberculosis iles T-box in complex with tRNA-3'-oh in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6UFG
Type
RNA
Length
239 nucleotides
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (77-mer); RNA (166-mer)
Ligands
MG, K
Pockets
6 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
BRNA (77-mer)rna77——
ARNA (166-mer)rna162——

Ligands and binding sites

  • MG · Magnesium ion · metal · 11 copies · chains B, A
  • K · Potassium ion · metal · 4 copies · chains B, A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18700.710.7755K
29430.670.7442MG
37820.640.7443MG
46320.640.7633empty
5680.290.7513MG

Interfaces

1 interface between chains.

  • B–A · 894 Ų buried · 54 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 2 modified (nucleotide modification).

Compared structures

  • 6UFG · Co-crystal structure of M. tuberculosis ileS T-box in complex with tRNA-3'-OH · the same entry in another collection · chain B against B, TM-score 1.00

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