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MolNFT v1 · #160761 · protein

Dark, room temperature, pcm myxobacterial phytochrome, P2, wild type

6PTQ · Photoreceptor-histidine kinase bphp: “Dark, room temperature, pcm myxobacterial phytochrome, P2, wild type”. X-ray diffraction, 2 ligands (EL5, BEN), 10 pockets (best druggability 0.81). MolNFT v1 #160761 on GenesisL1: 3D structure…

PDB
6PTQ
Type
protein
Length
964 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Photoreceptor-histidine kinase bphp
UniProt
Q09E27
Ligands
EL5, BEN
Pockets
10 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BPhotoreceptor-histidine kinase bphpprotein48234% helix, 27% strandQ09E27

Ligands and binding sites

  • EL5 · Biliverdin · ligand · 2 copies · chains A, B
  • BEN · Benzamidine · ligand · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13530.810.9043EL5
23050.810.9242EL5
33510.700.8338BEN
42830.600.7946empty
52330.580.7929empty

Interfaces

1 interface between chains.

  • A–B · 1590 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 covalent (covalent ligand).

Compared structures

  • 6PTQ · Dark, Room Temperature, PCM Myxobacterial Phytochrome, P2, Wild Type · the same entry in another collection · chain A against A, TM-score 1.00

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