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2.1 ångström crystal structure of stage II sporulation protein D from bacillus anthracis

Analyse 2.1 ångström crystal structure of stage II sporulation protein D from bacillus… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4RWR
Type
protein
Length
535 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Stage II sporulation protein D
UniProt
Q81K14
Pockets
5 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStage II sporulation protein Dprotein26736% helix, 24% strandQ81K14
BStage II sporulation protein Dprotein26836% helix, 23% strandQ81K14

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15770.700.7956empty
26000.670.7765empty
3880.430.7916empty
4560.360.7810empty
5520.290.7611empty

Interfaces

1 interface between chains.

  • A–B · 541 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 modified (engineered).

Compared structures

  • 4RWR · 2.1 Angstrom Crystal Structure of Stage II Sporulation Protein D from Bacillus anthracis · the same entry in another collection · chain A against A, TM-score 1.00

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