4RDD

Co-crystal structure of SHP2 in complex with a Cefsulodin derivative

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Tyrosine-protein phosphatase non-receptor type 11	polymer	275	32146.5	1	UniProt (Q06124) Pfam (PF00102) In PDB	Homo sapiens (human)	Protein-tyrosine phosphatase 1D, PTP-1D, Protein-tyrosine phosphatase 2C, PTP-2C, SH-PTP2, SHP-2, Shp2, SH-PTP3
2	A	1-({(2R)-4-carboxy-2-[(R)-carboxy{[(2R)-2-phenyl-2-sulfoacetyl]amino}methyl]-3,6-dihydro-2H-1,3-thiazin-5-yl}methyl)pyridinium	non-polymer		508.5	1	Chemie (3LU)
3		water	water		18.0	368	Chemie (HOH)

Sequence modifications

A: 262 - 528 (UniProt: Q06124)

PDB	External Database	Details
-	Gln 408	SEE REMARK 999
-	Ala 409	SEE REMARK 999
-	Leu 410	SEE REMARK 999
-	Leu 411	SEE REMARK 999
Leu 529	-	EXPRESSION TAG
Glu 530	-	EXPRESSION TAG
His 531	-	EXPRESSION TAG
His 532	-	EXPRESSION TAG
His 533	-	EXPRESSION TAG
His 534	-	EXPRESSION TAG
His 535	-	EXPRESSION TAG
His 536	-	EXPRESSION TAG

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	32146.5
Non-Polymers*	Number of molecules	1
	Total formula weight	508.5
All*	Total formula weight	32655.1

*Water molecules are not included.