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Crystal structure of monobody NSA1/SHP2 N-SH2 domain complex

Analyse Crystal structure of monobody NSA1/SHP2 N-SH2 domain complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4JE4
Type
protein
Length
195 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tyrosine-protein phosphatase non-receptor type 11; Monobody NSA1
UniProt
Q06124
Pockets
1 · best druggability 0.26

Structure

x-ray diffraction · 2 distinct chains · 11% helix, 43% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATyrosine-protein phosphatase non-receptor type 11protein10221% helix, 29% strandQ06124
BMonobody NSA1protein930% helix, 57% strand—

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1580.260.7320empty

Interfaces

1 interface between chains.

  • A–B · 943 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 4JE4 · Crystal Structure of Monobody NSa1/SHP2 N-SH2 Domain Complex · the same entry in another collection · chain A against A, TM-score 1.00

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