GL1X · GenesisL1 explorer

MolNFT v1 · #185440 · protein

Human SMG1-8-9 kinase complex with AlphaFold predicted SMG8 C- terminus, bound to a SMG1 inhibitor

7PW5: “Human SMG1-8-9 kinase complex with AlphaFold predicted SMG8 C- terminus, bound to a SMG1 inhibitor”. Electron microscopy, 4 ligands (IHP, 88C, ATP). MolNFT v1 #185440 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7PW5
Type
protein
Length
2,956 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q96Q15, Q8ND04, Q9H0W8
Ligands
IHP, 88C, ATP, MG

Structure

electron microscopy · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein1944—Q96Q15
B—protein702—Q8ND04
C—protein310—Q9H0W8

Ligands and binding sites

  • IHP · Inositol hexakisphosphate · ligand · chains A
  • 88C · 1-[4-[4-[2-[[4-chloranyl-3-(diethylsulfamoyl) phenyl]amino]pyrimidin-4-yl]pyridin-2-yl]phenyl]-3-methyl-urea · ligand · chains A
  • ATP · Adenosine-5'-triphosphate · ligand · chains C
  • MG · Magnesium ion · metal · chains C

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

Compared structures

  • 7PW5 · Human SMG1-8-9 kinase complex with AlphaFold predicted SMG8 C-terminus, bound to a SMG1… · the same entry in another collection · chain C against C, TM-score 1.00
  • 7PW4 · Human SMG1-8-9 kinase complex bound to a SMG1 inhibitor · an experimental structure of the same protein · chain C against C, TM-score 1.00
  • 7PW4 · Human SMG1-8-9 kinase complex bound to a SMG1 inhibitor · an experimental structure of the same protein · chain C against C, TM-score 1.00
  • 7PW7 · Human SMG1-9 kinase complex bound to a SMG1 inhibitor · an experimental structure of the same protein · chain A against A, TM-score 1.00
  • 7PW7 · Human SMG1-9 kinase complex bound to a SMG1 inhibitor · an experimental structure of the same protein · chain A against A, TM-score 1.00
  • 7PW8 · Human SMG1-8-9 kinase complex bound to AMPPNP · an experimental structure of the same protein · chain A against A, TM-score 1.00
  • 7PW8 · Human SMG1-8-9 kinase complex bound to amppnp · an experimental structure of the same protein · chain A against A, TM-score 1.00
  • 6Z3R · Structure of SMG1-8-9 kinase complex bound to UPF1-LSQ · an experimental structure of the same protein · chain A against A, TM-score 1.00

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