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Crystal structure of the transcriptional regulator cadr from P. putida in complex with DNA

Analyse Crystal structure of the transcriptional regulator cadr from P. putida in… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JGW
Type
protein + DNA
Length
295 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cadr; DNA (27-mer)
UniProt
Q93TP7
Pockets
5 · best druggability 0.66

Structure

x-ray diffraction · 4 distinct chains · 71% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BCadrprotein11671% helix, 3% strandQ93TP7
ACadrprotein12570% helix, 3% strandQ93TP7
CDNA (27-mer)dna27——
DDNA (27-mer)dna27——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16910.660.7660empty
2570.360.7913empty
3560.320.7711empty
4670.300.7511empty
5630.260.7311empty

Interfaces

6 interfaces between chains.

  • B–A · 1924 Ų buried · 25 hydrogen bonds · protein-protein
  • C–D · 1196 Ų buried · 115 hydrogen bonds · nucleic-nucleic
  • A–C · 474 Ų buried · 10 hydrogen bonds · protein-nucleic
  • B–D · 468 Ų buried · 6 hydrogen bonds · protein-nucleic
  • B–C · 373 Ų buried · 8 hydrogen bonds · protein-nucleic

Compared structures

  • 6JGW · Crystal structure of the transcriptional regulator CadR from P. putida in complex with DNA · the same entry in another collection · chain B against B, TM-score 1.00

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