5T81

Rhombohedral crystal form of the EpoB NRPS cyclization-docking bidomain from Sorangium cellulosum

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	EpoB	polymer	541	61764.2	2	UniProt (Q9KIZ9) Pfam (PF18563) Pfam (PF00668) In PDB	Sorangium cellulosum
2	B	GLYCEROL	non-polymer		92.1	1	Chemie (GOL)
3		water	water		18.0	163	Chemie (HOH)

Sequence modifications

A, B: 1 - 497 (UniProt: Q9KIZ9)

PDB	External Database	Details
Met -43	-	expression tag
His -42	-	expression tag
His -41	-	expression tag
His -40	-	expression tag
His -39	-	expression tag
His -38	-	expression tag
His -37	-	expression tag
Ser -36	-	expression tag
Ser -35	-	expression tag
Gly -34	-	expression tag
Leu -33	-	expression tag
Val -32	-	expression tag
Pro -31	-	expression tag
Arg -30	-	expression tag
Gly -29	-	expression tag
Ser -28	-	expression tag
Gly -27	-	expression tag
Met -26	-	expression tag
Lys -25	-	expression tag
Glu -24	-	expression tag
Thr -23	-	expression tag
Ala -22	-	expression tag
Ala -21	-	expression tag
Ala -20	-	expression tag
Lys -19	-	expression tag
Phe -18	-	expression tag
Glu -17	-	expression tag
Arg -16	-	expression tag
Gln -15	-	expression tag
His -14	-	expression tag
Met -13	-	expression tag
Asp -12	-	expression tag
Ser -11	-	expression tag
Pro -10	-	expression tag
Asp -9	-	expression tag
Leu -8	-	expression tag
Gly -7	-	expression tag
Thr -6	-	expression tag
Asp -5	-	expression tag
Asp -4	-	expression tag
Asp -3	-	expression tag
Asp -2	-	expression tag
Lys -1	-	expression tag
Ala 0	-	expression tag
Ala 2	Thr 2	see remark 999

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	123528.4
Non-Polymers*	Number of molecules	1
	Total formula weight	92.1
All*	Total formula weight	123620.5

*Water molecules are not included.