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Crystal structure of EV71 rdrp in complex with GTP

Analyse Crystal structure of EV71 rdrp in complex with GTP in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3N6M
Type
protein
Length
462 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA-dependent RNA polymerase
UniProt
D3K0N8
Ligands
GTP, NI
Pockets
4 · best druggability 0.73

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARNA-dependent RNA polymeraseprotein46242% helix, 16% strandD3K0N8

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · chains A
  • NI · Nickel (II) ion · metal · chains A

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13610.730.8452empty
23600.560.7537GTP
32020.500.7628empty
4960.370.7518empty

Compared structures

  • 3N6M · Crystal structure of EV71 RdRp in complex with GTP · the same entry in another collection · chain A against A, TM-score 1.00

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