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MolNFT v1 · #190026 · protein

Cryo-EM structure of N-terminal modified human vasoactive intestinal polypeptide receptor 2 (VIP2R) in complex with PACAP27 and gs

7WBJ: “Cryo-EM structure of N-terminal modified human vasoactive intestinal polypeptide receptor 2 (VIP2R) in…”. Electron microscopy, 15 pockets (best druggability 0.80). MolNFT v1 #190026 on GenesisL1: 3D structure, binding sites and…

PDB
7WBJ
Type
protein
Length
1,146 residues
Chains
6
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Vasoactive intestinal polypeptide receptor 2; Pituitary adenylate cyclase-activating…
UniProt
P41587, P18509, P04896, P54311, P63212
Pockets
15 · best druggability 0.80

Structure

electron microscopy · 6 distinct chains · 35% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
RVasoactive intestinal polypeptide receptor 2protein35959% helix, 4% strandP41587
LPituitary adenylate cyclase-activating polypeptide 27protein2793% helix, 0% strandP18509
AGuanine nucleotide-binding protein G(S) subunit alpha isoforms shortprotein23745% helix, 16% strandP04896
BGuanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1protein3407% helix, 34% strandP54311
GGuanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2protein5549% helix, 0% strandP63212
NNanobody-35protein1280% helix, 38% strand—

Pockets

15 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16830.800.8552empty
28040.730.7858empty
311720.710.7587empty
43490.690.8248empty
51650.650.8626empty

Interfaces

7 interfaces between chains.

  • B–G · 2021 Ų buried · 12 hydrogen bonds · protein-protein
  • R–L · 1526 Ų buried · 8 hydrogen bonds · protein-protein
  • A–B · 1420 Ų buried · 14 hydrogen bonds · protein-protein
  • R–A · 985 Ų buried · 12 hydrogen bonds · protein-protein
  • A–N · 935 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 7WBJ · Cryo-EM structure of N-terminal modified human vasoactive intestinal polypeptide receptor… · the same entry in another collection · chain N against N, 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 0.98
  • P41587 · AlphaFold monomer V2.0 prediction for vasoactive intestinal polypeptide receptor 2… · a predicted model of the same protein · chain R against A, TM-score 0.89
  • P04896 · 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 0.83
  • P18509 · AlphaFold monomer V2.0 prediction for pituitary adenylate cyclase- activating polypeptide… · a predicted model of the same protein · chain L against A, TM-score 0.79
  • 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 0.60

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