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MolNFT v1 · #180365 · protein + RNA

Cryo-EM structure of ephydatia fluviatilis piwia-pirna complex

7KX7 · Piwi-a: “Cryo-EM structure of ephydatia fluviatilis piwia-pirna complex”. Electron microscopy, 1 ligand (MG), 7 pockets (best druggability 0.71). MolNFT v1 #180365 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7KX7
Type
protein + RNA
Length
736 residues
Chains
2
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Piwi-a; RNA (5'-R(P*UP*CP*UP*CP*AP*GP*(OMC))-3')
EC
3.1.26.-
UniProt
D5MRY8
Ligands
MG
Pockets
7 · best druggability 0.71

Structure

electron microscopy · 2 distinct chains · 28% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APiwi-a (EC 3.1.26.-)protein72928% helix, 23% strandD5MRY8
BRNA (5'-R(P*UP*CP*UP*CP*AP*GP*(OMC))-3')rna7——

Ligands and binding sites

  • MG · Magnesium ion · metal · 2 copies · chains A, B

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

Pockets

7 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110150.710.7590MG
23910.680.8147empty
3510.420.8313empty
41040.410.7718empty
5620.400.8019empty

Interfaces

1 interface between chains.

  • A–B · 1061 Ų buried · 31 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 7KX7 · Cryo-EM structure of Ephydatia fluviatilis PiwiA-piRNA complex · the same entry in another collection · chain A against A, TM-score 1.00

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