1YS1

Burkholderia cepacia lipase complexed with hexylphosphonic acid (R)-2-methyl-3-phenylpropyl ester

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	X	Lipase	polymer	320	33060.6	1	UniProt (P22088) Pfam (PF00561) In PDB	Burkholderia cepacia	Triacylglycerol lipase
2	X	CALCIUM ION	non-polymer		40.1	1	Chemie (CA)
3	X	HEXYLPHOSPHONIC ACID (R)-2-METHYL-3-PHENYLPROPYL ESTER	non-polymer		298.4	1	Chemie (2HR)
4		water	water		18.0	147	Chemie (HOH)

Sequence modifications

X: 1 - 320 (UniProt: P22088)

PDB	External Database	Details
Asp 2	Ala 46	SEE REMARK 999
Asn 3	Gly 47	SEE REMARK 999
Thr 18	Ser 62	SEE REMARK 999
Arg 40	Asn 84	SEE REMARK 999
Thr 92	Ser 136	SEE REMARK 999
Gly 125	Asp 169	SEE REMARK 999
Thr 137	Ser 181	SEE REMARK 999
Asn 154	His 198	SEE REMARK 999
Lys 165	Gln 209	SEE REMARK 999
Gln 171	Arg 215	SEE REMARK 999
Ile 218	Leu 262	SEE REMARK 999
Gly 221	Phe 265	SEE REMARK 999
Ile 232	Leu 276	SEE REMARK 999
Ala 240	Val 284	SEE REMARK 999
Pro 243	Leu 287	SEE REMARK 999
Val 256	Ile 300	SEE REMARK 999
Val 266	Leu 310	SEE REMARK 999
Gln 276	Lys 320	SEE REMARK 999
Asn 300	Tyr 344	SEE REMARK 999

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	33060.6
Non-Polymers*	Number of molecules	2
	Total formula weight	338.4
All*	Total formula weight	33399.1

*Water molecules are not included.