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MolNFT v1 · #186276 · protein + DNA

Crystal structure of pseudooceanicola lipolyticus argonaute bound to 5' P guide DNA

7R8H: “Crystal structure of pseudooceanicola lipolyticus argonaute bound to 5' P guide DNA”. X-ray diffraction, 6 pockets (best druggability 0.79). MolNFT v1 #186276 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7R8H
Type
protein + DNA
Length
787 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Argonaute; DNA (5'- D(*TP*TP*AP*CP*TP*GP*CP*AP*CP*AP*GP*GP*TP*GP*AP*CP*GP*A)-3')
UniProt
A0A2M8J4C7
Pockets
6 · best druggability 0.79

Structure

x-ray diffraction · 2 distinct chains · 28% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AArgonauteprotein76928% helix, 28% strandA0A2M8J4C7
TDNA (5'- D(*TP*TP*AP*CP*TP*GP*CP*AP*CP*AP*GP*GP*TP*GP*AP*CP*GP*A)-3')dna18——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15140.790.8660empty
22740.750.8833empty
32220.680.8626empty
41150.600.8624empty
51280.470.7820empty

Interfaces

1 interface between chains.

  • A–T · 2623 Ų buried · 46 hydrogen bonds · protein-nucleic

Compared structures

  • 7R8H · Crystal structure of Pseudooceanicola lipolyticus Argonaute bound to 5' p guide DNA · the same entry in another collection · chain A against A, TM-score 1.00

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