5OVX

X-Ray Characterization of Striatal-Enriched Protein Tyrosine Phosphatase Inhibitors

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 5	polymer	305	35220.8	1	UniProt (P54829) Pfam (PF00102) In PDB	Homo sapiens (Human)	Neural-specific protein-tyrosine phosphatase,Striatum-enriched protein-tyrosine phosphatase,STEP
2	A	[(~{S})-[4-[3-[(~{S})-(3,4-dichlorophenyl)-oxidanyl-methyl]phenyl]phenyl]-oxidanyl-methyl]phosphonic acid	non-polymer		439.2	1	Chemie (AY5)
3		water	water		18.0	252	Chemie (HOH)

Sequence modifications

A: 258 - 539 (UniProt: P54829)

PDB	External Database	Details
Met 235	-	initiating methionine
His 236	-	expression tag
His 237	-	expression tag
His 238	-	expression tag
His 239	-	expression tag
His 240	-	expression tag
His 241	-	expression tag
Ser 242	-	expression tag
Ser 243	-	expression tag
Gly 244	-	expression tag
Val 245	-	expression tag
Asp 246	-	expression tag
Leu 247	-	expression tag
Gly 248	-	expression tag
Thr 249	-	expression tag
Glu 250	-	expression tag
Asn 251	-	expression tag
Leu 252	-	expression tag
Tyr 253	-	expression tag
Phe 254	-	expression tag
Gln 255	-	expression tag
Ser 256	-	expression tag
Met 257	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	35220.8
Non-Polymers*	Number of molecules	1
	Total formula weight	439.2
All*	Total formula weight	35660.1

*Water molecules are not included.