7XUQ

Crystal structure of Tpe3.0 complexed with N-Boc-3-alkenylindole

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Transcriptional regulator, PadR-like family	polymer	132	15135.0	1	UniProt (A2RI36) Pfam (PF03551) In PDB	Lactococcus lactis subsp. cremoris MG1363
2	A	dimethyl 2-[[2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]methyl]-2-prop-2-enyl-propanedioate	non-polymer		415.5	1	Chemie (I1A)
3		water	water		18.0	11	Chemie (HOH)

Sequence modifications

A: 2 - 116 (UniProt: A2RI36)

PDB	External Database	Details
Met 0	-	initiating methionine
Gly 1	-	expression tag
Leu 8	Met 8	engineered mutation
Asp 55	Lys 55	engineered mutation
Gln 59	Lys 59	engineered mutation
Dff 93	Phe 93	conflict
Leu 96	Trp 96	engineered mutation
Ser 117	-	expression tag
Arg 118	-	expression tag
Gly 119	-	expression tag
Gly 120	-	expression tag
Ser 121	-	expression tag
Gly 122	-	expression tag
Gly 123	-	expression tag
Trp 124	-	expression tag
Ser 125	-	expression tag
His 126	-	expression tag
Pro 127	-	expression tag
Gln 128	-	expression tag
Phe 129	-	expression tag
Glu 130	-	expression tag
Lys 131	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	15135.0
Non-Polymers*	Number of molecules	1
	Total formula weight	415.5
All*	Total formula weight	15550.5

*Water molecules are not included.