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MolNFT v1 · #50085 · protein + RNA

Crystal structure of rotavirus SA11 VP1/RNA (ggcuuu) complex

2R7V · RNA (5'-R(*G*GP*CP*UP*UP*U)-3'): “Crystal structure of rotavirus SA11 VP1/RNA (ggcuuu) complex”. X-ray diffraction, 17 pockets (best druggability 0.85). MolNFT v1 #50085 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2R7V
Type
protein + RNA
Length
1,078 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RNA (5'-R(*G*GP*CP*UP*UP*U)-3'); RNA-dependent RNA polymerase
UniProt
O37061
Pockets
17 · best druggability 0.85

Structure

x-ray diffraction · 2 distinct chains · 52% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XRNA (5'-R(*G*GP*CP*UP*UP*U)-3')rna5——
ARNA-dependent RNA polymeraseprotein107352% helix, 13% strandO37061

Pockets

17 pockets found on a 1 Å grid, 8 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110750.850.86118empty
26210.750.8256empty
33170.710.8437empty
44580.660.7942empty
51490.610.8423empty

Interfaces

1 interface between chains.

  • X–A · 625 Ų buried · 13 hydrogen bonds · protein-nucleic

Compared structures

  • 2R7V · Crystal Structure of Rotavirus SA11 VP1/RNA (GGCUUU) Complex · the same entry in another collection · chain X against X, TM-score 1.00

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