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MolNFT v1 · #187898 · protein

Crystal structure of a superbinder fes SH2 domain (SFES1) in complex with a high affinity phosphopeptide

7T1K · Tyrosine-protein kinase FES/FPS: “Crystal structure of a superbinder fes SH2 domain (SFES1) in complex with a high affinity phosphopeptide”. X-ray diffraction, 2 ligands (NA, CL). MolNFT v1 #187898 on GenesisL1: 3D structure…

PDB
7T1K
Type
protein
Length
108 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tyrosine-protein kinase FES/FPS; Synthetic phosphotyrosine-containing ezrin-derived…
EC
2.7.10.2
UniProt
P07332, P15311
Ligands
NA, CL

Structure

x-ray diffraction · 2 distinct chains · 19% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATyrosine-protein kinase FES/FPS (EC 2.7.10.2)protein10221% helix, 26% strandP07332
BSynthetic phosphotyrosine-containing ezrin-derived peptideprotein60% helix, 0% strandP15311

Ligands and binding sites

  • NA · Sodium ion · metal · chains A
  • CL · Chloride ion · ion · 2 copies · chains A
  • EDO · 1,2-ethanediol · additive · 2 copies · chains A, B
  • MLI · Malonate ion · additive · chains A

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

Interfaces

1 interface between chains.

  • A–B · 509 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 modified (phosphorylation).

Compared structures

  • 7T1K · Crystal structure of a superbinder Fes SH2 domain (sFes1) in complex with a high affinity… · the same entry in another collection · chain A against A, TM-score 1.00
  • P07332 · AlphaFold monomer V2.0 prediction for tyrosine-protein kinase FES/FPS (P07332) · a predicted model of the same protein · chain A against A, TM-score 0.97
  • P15311 · AlphaFold monomer V2.0 prediction for ezrin (P15311) · a predicted model of the same protein · chain B against A, TM-score 0.68

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