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PTH-bound human PTH1R in complex with Gs (class4)

Analyse PTH-bound human PTH1R in complex with Gs (class4) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7VVN
Type
protein
Length
1,086 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.8
Source
Bos taurus; Homo sapiens; Rattus norvegicus; unidentified; SYNTHETIC CONSTRUCT
Molecule
Guanine nucleotide-binding protein G(s) subunit alpha isoforms short; Guanine…
UniProt
P63092, P54311, P63212, P01270, Q03431
Pockets
15 · best druggability 0.83

Structure

electron microscopy · resolution 3.8 · 6 distinct chains · 37% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGuanine nucleotide-binding protein G(s) subunit alpha isoforms shortprotein23047% helix, 16% strandP63092
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3388% helix, 41% strandP54311
GGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5659% helix, 0% strandP63212
Nnanobody Nb35protein1282% helix, 36% strand—
PParathyroid hormoneprotein3482% helix, 0% strandP01270
RParathyroid hormone/parathyroid hormone-related peptide receptorprotein30066% helix, 1% strandQ03431

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17270.830.8774empty
28270.720.7756empty
35130.700.8049empty
49620.690.7475empty
52150.630.8335empty

Interfaces

7 interfaces between chains.

  • B–G · 2063 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1449 Ų buried · 20 hydrogen bonds · protein-protein
  • A–N · 948 Ų buried · 12 hydrogen bonds · protein-protein
  • A–R · 903 Ų buried · 5 hydrogen bonds · protein-protein
  • P–R · 754 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 7VVN · Pth-bound human PTH1R in complex with gs (CLASS4) · the same entry in another collection · chain R against R, TM-score 1.00
  • P54311 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I)/G(S)/G(T)… · a predicted model of the same protein · chain B against A, TM-score 0.99
  • Q03431 · AlphaFold monomer V2.0 prediction for parathyroid HORMONE/PARATHYROID hormone-related… · a predicted model of the same protein · chain R against A, TM-score 0.87
  • P63092 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(S) subunit… · a predicted model of the same protein · chain A against A, TM-score 0.85
  • P63212 · AlphaFold monomer V2.0 prediction for guanine nucleotide-binding protein G(I)/G(S)/G(O)… · a predicted model of the same protein · chain G against A, TM-score 0.68
  • P01270 · AlphaFold monomer V2.0 prediction for parathyroid hormone (P01270) · a predicted model of the same protein · chain P against A, TM-score 0.50

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