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Crystal structure of the mycobacterium tuberculosis hypoxic response regulator dosr C-terminal domain-DNA complex

Analyse Crystal structure of the mycobacterium tuberculosis hypoxic response regulator… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1ZLK
Type
protein + DNA
Length
179 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
5'- D(*GP*GP*CP*CP*CP*GP*CP*GP*CP*TP*TP*TP*GP*GP*GP*GP*AP*CP*TP…
Pockets
3 · best druggability 0.58

Structure

x-ray diffraction · 3 distinct chains · 55% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
C5'- D(*GP*GP*CP*CP*CP*GP*CP*GP*CP*TP*TP*TP*GP*GP*GP*GP*AP*CP*TP *AP*AP*AP*GP*TP*CP*CP*CP*TP*AP*AP*CP*CP*CP*TP*GP*GP*CP*CP*A P*CP*GP*AP*T)-3'dna24——
D5'- D(*CP*GP*TP*GP*GP*CP*CP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*AP*CP *TP*TP*TP*AP*GP*TP*CP*CP*CP*CP*AP*AP*AP*GP*CP*GP*CP*GP*GP*G P*CP*CP*AP*T)-3'dna25——
A, BDormancy survival regulatorprotein6555% helix, 0% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11600.580.8322empty
21010.410.7716empty
3940.390.7717empty

Interfaces

6 interfaces between chains.

  • C–D · 997 Ų buried · 76 hydrogen bonds · nucleic-nucleic
  • A–B · 528 Ų buried · 5 hydrogen bonds · protein-protein
  • C–A · 397 Ų buried · 10 hydrogen bonds · protein-nucleic
  • D–B · 394 Ų buried · 6 hydrogen bonds · protein-nucleic
  • C–B · 377 Ų buried · 8 hydrogen bonds · protein-nucleic

Compared structures

  • 1ZLK · Crystal Structure of the Mycobacterium tuberculosis Hypoxic Response Regulator DosR… · the same entry in another collection · chain C against C, TM-score 1.00

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