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MolNFT v1 · #156474 · protein

Crystal structure of hink, a lysr family transcriptional regulator from pseudomonas aeruginosa

6M5F · Probable transcriptional regulator: “Crystal structure of hink, a lysr family transcriptional regulator from pseudomonas aeruginosa”. X-ray diffraction, 14 pockets (best druggability 0.84). MolNFT v1 #156474 on GenesisL1: 3D…

PDB
6M5F
Type
protein
Length
1,156 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Probable transcriptional regulator
UniProt
Q9I6S0
Pockets
14 · best druggability 0.84

Structure

x-ray diffraction · 4 distinct chains · 42% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProbable transcriptional regulatorprotein28643% helix, 21% strandQ9I6S0
BProbable transcriptional regulatorprotein29341% helix, 20% strandQ9I6S0
CProbable transcriptional regulatorprotein28741% helix, 22% strandQ9I6S0
DProbable transcriptional regulatorprotein29041% helix, 21% strandQ9I6S0

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111070.840.85102empty
210730.780.8092empty
310360.750.7896empty
4750.640.9122empty
51870.620.8328empty

Interfaces

6 interfaces between chains.

  • A–C · 1717 Ų buried · 15 hydrogen bonds · protein-protein
  • B–D · 1656 Ų buried · 14 hydrogen bonds · protein-protein
  • B–C · 1499 Ų buried · 11 hydrogen bonds · protein-protein
  • A–D · 1269 Ų buried · 15 hydrogen bonds · protein-protein
  • C–D · 1029 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 6M5F · Crystal structure of HinK, a LysR family transcriptional regulator from Pseudomonas… · the same entry in another collection · chain C against C, TM-score 1.00

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