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Naegleria gruberi RNA ligase E312A mutant with AMP and mn

Analyse Naegleria gruberi RNA ligase E312A mutant with AMP and mn in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6VT8
Type
protein
Length
336 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA ligase
UniProt
D2W2Z5
Ligands
AMP, MN
Pockets
2 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 20% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA ligaseprotein33620% helix, 35% strandD2W2Z5

Ligands and binding sites

  • AMP · Adenosine monophosphate · ligand · chains A
  • MN · Manganese (II) 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15900.790.8562AMP, MN
22320.570.7822empty

Modifications

Observed in the structure: 1 covalent (covalent ligand).

Compared structures

  • 6VT8 · Naegleria gruberi RNA ligase E312A mutant with AMP and Mn · the same entry in another collection · chain A against A, TM-score 1.00

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