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Capsid model of M13 bacteriophage virus from magic-angle spinning NMR and rosetta modeling

Analyse Capsid model of M13 bacteriophage virus from magic-angle spinning NMR and… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2MJZ
Type
protein
Length
1,750 residues
Chains
35
Method
solid-state nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Capsid protein G8P
UniProt
P69541
Pockets
20 · best druggability 0.55

Structure

solid-state nmr · 1 distinct chain · 86% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, E, F, G, H, I, J, K, L, M, N, O, P, Q, R, S, T, U, V, W, X, Y, Z, a, b, c, d, e, f, g, h, iCapsid protein G8Pprotein5086% helix, 0% strandP69541

Pockets

20 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13240.550.7434empty
22840.530.7428empty
32800.520.7433empty
42780.520.7430empty
52600.520.7432empty

Interfaces

105 interfaces between chains.

  • D–h · 677 Ų buried · 2 hydrogen bonds · protein-protein
  • Q–V · 676 Ų buried · 2 hydrogen bonds · protein-protein
  • T–Y · 676 Ų buried · 2 hydrogen bonds · protein-protein
  • P–U · 675 Ų buried · 2 hydrogen bonds · protein-protein
  • K–P · 675 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 2MJZ · Capsid model of M13 bacteriophage virus from Magic-angle spinning NMR and Rosetta modeling · the same entry in another collection · chain A against A, TM-score 1.00

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