3I3L

Crystal structure of CmlS, a flavin-dependent halogenase

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Alkylhalidase CmlS	polymer	591	66534.4	1	UniProt (Q9AL91) Pfam (PF01494) Pfam (PF22045) In PDB	Streptomyces venezuelae
2	A	FLAVIN-ADENINE DINUCLEOTIDE	non-polymer		785.5	1	Chemie (FAD)
3		water	water		18.0	232	Chemie (HOH)

Sequence modifications

A: 1 - 571 (UniProt: Q9AL91)

PDB	External Database	Details
Met -19	-	EXPRESSION TAG
Gly -18	-	EXPRESSION TAG
Ser -17	-	EXPRESSION TAG
Ser -16	-	EXPRESSION TAG
His -15	-	EXPRESSION TAG
His -14	-	EXPRESSION TAG
His -13	-	EXPRESSION TAG
His -12	-	EXPRESSION TAG
His -11	-	EXPRESSION TAG
His -10	-	EXPRESSION TAG
Ser -9	-	EXPRESSION TAG
Ser -8	-	EXPRESSION TAG
Gly -7	-	EXPRESSION TAG
Leu -6	-	EXPRESSION TAG
Val -5	-	EXPRESSION TAG
Pro -4	-	EXPRESSION TAG
Arg -3	-	EXPRESSION TAG
Gly -2	-	EXPRESSION TAG
Ser -1	-	EXPRESSION TAG
His 0	-	EXPRESSION TAG
-	Ile 303	SEE REMARK 999
-	Phe 304	SEE REMARK 999
-	Arg 305	SEE REMARK 999
-	Arg 306	SEE REMARK 999
-	Ser 307	SEE REMARK 999
-	Val 308	SEE REMARK 999

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	66534.4
Non-Polymers*	Number of molecules	1
	Total formula weight	785.5
All*	Total formula weight	67320.0

*Water molecules are not included.