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Crystal structure of non-canonical dimeric guanylyl cyclase domain of rhogc fusion protein from the aquatic fungus blastocladiella emersonii

Analyse Crystal structure of non-canonical dimeric guanylyl cyclase domain of rhogc… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6AOB
Type
protein
Length
358 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Bacterio-RHODOPSIN/GUANYLYL cyclase 1 fusion protein
UniProt
A0A060H1D7
Ligands
MN
Pockets
4 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABacterio-RHODOPSIN/GUANYLYL cyclase 1 fusion proteinprotein18036% helix, 32% strandA0A060H1D7
BBacterio-RHODOPSIN/GUANYLYL cyclase 1 fusion proteinprotein17836% helix, 34% strandA0A060H1D7

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains A, B
  • TLA · L(+)-tartaric acid · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12600.830.9543empty
21640.510.7935empty
31290.450.7717empty
4630.310.7516empty

Interfaces

1 interface between chains.

  • A–B · 1334 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 6AOB · Crystal structure of non-canonical dimeric guanylyl cyclase domain of RhoGC fusion… · the same entry in another collection · chain A against A, TM-score 1.00

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