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Solution NMR structure of the homodimeric winged helix-turn-helix DNA- binding domain (fragment 1-100) MB0332 from mycobacterium bovis, a possible arsr-family transcriptional regulator. northeast structural genomics consortium target MBR242E.

Analyse Solution NMR structure of the homodimeric winged helix-turn-helix DNA- binding… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2KKO
Type
protein
Length
216 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Possible transcriptional regulatory protein (possibly arsr- family)
UniProt
Q7U294
Pockets
2 · best druggability 0.67

Structure

solution nmr · 1 distinct chain · 57% helix, 13% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPossible transcriptional regulatory protein (possibly arsr- family)protein10857% helix, 13% strandQ7U294

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1820.670.9226empty
2880.480.8216empty

Interfaces

1 interface between chains.

  • A–B · 1284 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 2KKO · Solution NMR structure of the homodimeric winged helix-turn-helix DNA-binding domain… · the same entry in another collection · chain A against A, TM-score 1.00

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