8S1Y

ThaOS V79A

This is a non-PDB format compatible entry.

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)	8-amino-7-oxononanoate synthase/2-amino-3-ketobutyrate coenzyme A ligase	polymer	421	46557.1	2	UniProt (Q5SHZ8) Pfam (PF00155)	Thermus thermophilus	AONS/AKB ligase,7-keto-8-amino-pelargonic acid synthase,7-KAP synthase,KAPA synthase,8-amino-7-ketopelargonate synthase,Alpha-oxoamine synthase,Glycine acetyltransferase
2	C, D, F, G, H... (A, B)	(4S)-2-METHYL-2,4-PENTANEDIOL	non-polymer		118.2	6	Chemie (MPD)
3	E, J (A, B)	(2~{R},4~{R})-5,5-dimethyl-2-[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid	non-polymer		378.3	2	Chemie (A1H4V)
4	K, L (A, B)	water	water		18.0	555	Chemie (HOH)

Sequence modifications

A, B: 3 - 396 (UniProt: Q5SHZ8)

PDB	External Database	Details
Met -24	-	initiating methionine
Ser -23	-	expression tag
Tyr -22	-	expression tag
Tyr -21	-	expression tag
His -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
Asp -14	-	expression tag
Tyr -13	-	expression tag
Asp -12	-	expression tag
Ile -11	-	expression tag
Pro -10	-	expression tag
Thr -9	-	expression tag
Thr -8	-	expression tag
Glu -7	-	expression tag
Asn -6	-	expression tag
Leu -5	-	expression tag
Tyr -4	-	expression tag
Phe -3	-	expression tag
Gln -2	-	expression tag
Gly -1	-	expression tag
Ala 0	-	expression tag
Met 1	-	expression tag
Gly 2	-	expression tag
Ala 79	Val 78	engineered mutation

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	93114.2
Non-Polymers*	Number of molecules	8
	Total formula weight	1465.7
All*	Total formula weight	94579.9

*Water molecules are not included.