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Crystal structure analysis of S.EPIDERMIDIS adhesin sdrg binding to fibrinogen (apo structure)

Analyse Crystal structure analysis of S.EPIDERMIDIS adhesin sdrg binding to fibrinogen… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1R19
Type
protein
Length
1,176 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fibrinogen-binding protein sdrg
UniProt
Q9KI13
Pockets
20 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 4% helix, 51% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFibrinogen-binding protein sdrgprotein2864% helix, 50% strandQ9KI13
BFibrinogen-binding protein sdrgprotein3003% helix, 53% strandQ9KI13
CFibrinogen-binding protein sdrgprotein2984% helix, 50% strandQ9KI13
DFibrinogen-binding protein sdrgprotein2923% helix, 52% strandQ9KI13

Pockets

20 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17920.720.78106empty
27440.700.7777empty
31970.680.8635empty
41730.670.8731empty
55020.640.7661empty

Interfaces

2 interfaces between chains.

  • A–D · 534 Ų buried · 8 hydrogen bonds · protein-protein
  • B–D · 461 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 1R19 · Crystal Structure Analysis of S.epidermidis adhesin SdrG binding to Fibrinogen (Apo… · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9KI13 · AlphaFold monomer V2.0 prediction for serine-aspartate repeat- containing protein G… · a predicted model of the same protein · chain C against A, TM-score 0.97

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