2LLE

Computational design of an eight-stranded (beta/alpha)-barrel from fragments of different folds

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Chemotaxis protein CheY, Imidazole glycerol phosphate synthase subunit HisF chimera	polymer	234	25607.6	1	UniProt (Q56312) UniProt (Q9X0C6) Pfam (PF00072) Pfam (PF00977) In PDB	Thermotoga maritima	IGP synthase cyclase subunit, IGP synthase subunit HisF, ImGP synthase subunit HisF, IGPS subunit HisF

Sequence modifications

A: 1 - 11 (UniProt: Q56312)

PDB	External Database	Details
Ile 4	Arg 4	engineered mutation

A: 12 - 81 (UniProt: Q56312)

PDB	External Database	Details
Gly 78	Asp 100	engineered mutation

A: 82 - 226 (UniProt: Q9X0C6)

PDB	External Database	Details
Leu 95	Ile 116	engineered mutation
Ala 201	Leu 222	engineered mutation
Gly 213	Val 234	engineered mutation
Leu 227	-	expression tag
Glu 228	-	expression tag
His 229	-	expression tag
His 230	-	expression tag
His 231	-	expression tag
His 232	-	expression tag
His 233	-	expression tag
His 234	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	25607.6
All*	Total formula weight	25607.6

*Water molecules are not included.