MolNFT v1 · #96244 · protein

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

4JE4 · Tyrosine-protein phosphatase non-receptor type 11: “Crystal structure of monobody NSA1/SHP2 N-SH2 domain complex”. X-ray diffraction, 1 pocket (best druggability 0.26). MolNFT v1 #96244 on GenesisL1: 3D structure, binding sites and…

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).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Tyrosine-protein phosphatase non-receptor type 11	protein	102	21% helix, 29% strand	Q06124
B	Monobody NSA1	protein	93	0% helix, 57% strand	—

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	58	0.26	0.73	20	empty

Interfaces

1 interface between chains.

A–B · 943 Å² 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

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt Q06124
Elsewhere: RCSB PDB 4JE4 · PDBe 4JE4 · UniProt Q06124

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