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MolNFT v1 · #176363 · protein

Crystal structure of dsba-like protein DR2335 from deinococcus radiodurans R1, native protein

7DK9 · Dsba domain-containing protein: “Crystal structure of dsba-like protein DR2335 from deinococcus radiodurans R1, native protein”. X-ray diffraction, 1 ligand (PO4), 4 pockets (best druggability 0.48). MolNFT v1 #176363 on GenesisL1…

PDB
7DK9
Type
protein
Length
423 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Dsba domain-containing protein
UniProt
Q9RRZ4
Ligands
PO4
Pockets
4 · best druggability 0.48

Structure

x-ray diffraction · 2 distinct chains · 52% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADsba domain-containing proteinprotein21253% helix, 11% strandQ9RRZ4
BDsba domain-containing proteinprotein21151% helix, 11% strandQ9RRZ4

Ligands and binding sites

  • PO4 · Phosphate ion · ion · chains A, B
  • PEG · Di(hydroxyethyl)ether · additive · chains B

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

Pockets

4 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11640.480.7725empty
21280.450.7720empty
3920.400.7817empty
4750.350.7618empty

Interfaces

1 interface between chains.

  • A–B · 1739 Ų buried · 34 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (oxidation).

Compared structures

  • 7DK9 · Crystal structure of DsbA-like protein DR2335 from Deinococcus radiodurans R1, native… · the same entry in another collection · chain A against A, TM-score 1.00

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