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MolNFT v1 · #138611 · protein

High resolution structure of mutant CA09-PB2CAP

5WOP · Polymerase PB2: “High resolution structure of mutant CA09-PB2CAP”. X-ray diffraction, 3 pockets (best druggability 0.64). MolNFT v1 #138611 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5WOP
Type
protein
Length
318 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polymerase PB2
UniProt
F4MEU3
Pockets
3 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 23% helix, 42% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPolymerase PB2protein15923% helix, 42% strandF4MEU3

Ligands and binding sites

  • GOL · Glycerol · additive · 4 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15170.640.7647empty
2770.390.7818empty
3650.390.7915empty

Interfaces

1 interface between chains.

  • A–B · 315 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 5WOP · High Resolution Structure of Mutant CA09-PB2cap · the same entry in another collection · chain A against A, TM-score 1.00

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