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Crystal structure of pyrrolysyl-tRNA synthetase from methanomethylophilus alvus

Analyse Crystal structure of pyrrolysyl-tRNA synthetase from methanomethylophilus alvus in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JP2
Type
protein
Length
1,097 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pyrrolysyl-tRNA synthetase
EC
6.1.1.26
UniProt
M9SC49
Pockets
15 · best druggability 0.78

Structure

x-ray diffraction · 4 distinct chains · 38% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APyrrolysyl-tRNA synthetase (EC 6.1.1.26)protein27738% helix, 22% strandM9SC49
BPyrrolysyl-tRNA synthetase (EC 6.1.1.26)protein27239% helix, 22% strandM9SC49
CPyrrolysyl-tRNA synthetase (EC 6.1.1.26)protein27637% helix, 23% strandM9SC49
DPyrrolysyl-tRNA synthetase (EC 6.1.1.26)protein27237% helix, 21% strandM9SC49

Pockets

15 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11240.780.9735empty
21200.780.9731empty
36890.720.7859empty
45910.710.7958empty
54430.680.8043empty

Interfaces

6 interfaces between chains.

  • A–C · 2336 Ų buried · 29 hydrogen bonds · protein-protein
  • B–D · 2321 Ų buried · 30 hydrogen bonds · protein-protein
  • A–B · 555 Ų buried · 9 hydrogen bonds · protein-protein
  • A–D · 207 Ų buried · 3 hydrogen bonds · protein-protein
  • B–C · 202 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6JP2 · Crystal structure of pyrrolysyl-tRNA synthetase from Methanomethylophilus alvus · the same entry in another collection · chain A against A, TM-score 1.00

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