4EF9

Crystal structure of dihydroorotate dehydrogenase from Leishmania major in complex with 4-Nitrophenyl isothiocyanate

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (A, B)	Dihydroorotate dehydrogenase	polymer	354	38159.5	2	UniProt (Q4QEW7) Pfam (PF01180)	Leishmania major
2	C, K (A, B)	N-(4-nitrophenyl)thioformamide	non-polymer		182.2	2	Chemie (4NF)
3	D, L (A, B)	FLAVIN MONONUCLEOTIDE	non-polymer		456.3	2	Chemie (FMN)
4	E, F, H, I, J... (A, B)	SULFATE ION	non-polymer		96.1	7	Chemie (SO4)
5	G, N (A, B)	GLYCEROL	non-polymer		92.1	2	Chemie (GOL)
6	P, Q (A, B)	water	water		18.0	536	Chemie (HOH)

Sequence modifications

A, B: 1 - 320 (UniProt: Q4QEW7)

PDB	External Database	Details
Met -33	-	expression tag
Gly -32	-	expression tag
Ser -31	-	expression tag
Ser -30	-	expression tag
His -29	-	expression tag
His -28	-	expression tag
His -27	-	expression tag
His -26	-	expression tag
His -25	-	expression tag
His -24	-	expression tag
Ser -23	-	expression tag
Ser -22	-	expression tag
Gly -21	-	expression tag
Leu -20	-	expression tag
Val -19	-	expression tag
Pro -18	-	expression tag
Ala -17	-	expression tag
Gly -16	-	expression tag
Ser -15	-	expression tag
His -14	-	expression tag
Met -13	-	expression tag
Ala -12	-	expression tag
Ser -11	-	expression tag
Met -10	-	expression tag
Thr -9	-	expression tag
Gly -8	-	expression tag
Gly -7	-	expression tag
Gln -6	-	expression tag
Gln -5	-	expression tag
Met -4	-	expression tag
Gly -3	-	expression tag
Arg -2	-	expression tag
Gly -1	-	expression tag
Ser 0	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	76319.1
Non-Polymers*	Number of molecules	13
	Total formula weight	2133.7
All*	Total formula weight	78452.8

*Water molecules are not included.