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Tetr family transcriptional regulator cifr C99T-C107S-C181R cysteines mutant complexed with 26BP double-strand operator DNA

Analyse Tetr family transcriptional regulator cifr C99T-C107S-C181R cysteines mutant… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6NSM
Type
protein + DNA
Length
438 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Copper outer membrane regulator; DNA (26-mer)
UniProt
A0A0F6UBT4
Pockets
7 · best druggability 0.74

Structure

x-ray diffraction · 4 distinct chains · 71% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACopper outer membrane regulatorprotein19470% helix, 0% strandA0A0F6UBT4
BCopper outer membrane regulatorprotein19272% helix, 0% strandA0A0F6UBT4
CDNA (26-mer)dna26——
DDNA (26-mer)dna26——

Pockets

7 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1700.740.9823empty
26070.720.8054empty
31370.630.8631empty
4870.340.7414empty
5850.330.7413empty

Interfaces

6 interfaces between chains.

  • A–B · 1834 Ų buried · 34 hydrogen bonds · protein-protein
  • C–D · 1102 Ų buried · 95 hydrogen bonds · nucleic-nucleic
  • A–D · 578 Ų buried · 11 hydrogen bonds · protein-nucleic
  • A–C · 540 Ų buried · 9 hydrogen bonds · protein-nucleic
  • B–C · 483 Ų buried · 6 hydrogen bonds · protein-nucleic

Compared structures

  • 6NSM · TetR family transcriptional regulator CifR C99T-C107S-C181R Cysteines mutant complexed… · the same entry in another collection · chain B against B, TM-score 1.00

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