5QDN

PanDDA analysis group deposition -- Crystal structure of PTP1B in complex with compound_FMOPL000163a

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 1	polymer	321	37345.6	1	UniProt (P18031) Pfam (PF00102) In PDB	Homo sapiens (Human)	Protein-tyrosine phosphatase 1B,PTP-1B
2	A	N-{4-[(2S)-butan-2-yl]phenyl}methanesulfonamide	non-polymer		227.3	1	Chemie (JFY)
3	A	2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL	non-polymer		122.1	1	Chemie (TRS)
4		water	water		18.0	213	Chemie (HOH)

Sequence modifications

A: 1 - 321 (UniProt: P18031)

PDB	External Database	Details
Ser 32	Cys 32	engineered mutation
Val 92	Cys 92	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	37345.6
Non-Polymers*	Number of molecules	2
	Total formula weight	349.5
All*	Total formula weight	37695.0

*Water molecules are not included.