6YC8

Crystal structure of KRED1-Pglu enzyme

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A	Ketoreductase	polymer	265	29208.2	1	UniProt (A0A0H4SN47) Pfam (PF00106) In PDB	Ogataea glucozyma
2	A	NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE	non-polymer		743.4	1	Chemie (NAP)
3	A	ACETATE ION	non-polymer		59.0	1	Chemie (ACT)
4	A	4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID	non-polymer		238.3	1	Chemie (EPE)
5	A	TRIETHYLENE GLYCOL	non-polymer		150.2	2	Chemie (PGE)
6	A	DI(HYDROXYETHYL)ETHER	non-polymer		106.1	4	Chemie (PEG)
7	A	1,2-ETHANEDIOL	non-polymer		62.1	2	Chemie (EDO)
8		water	water		18.0	158	Chemie (HOH)

Sequence modifications

A: 1 - 252 (UniProt: A0A0H4SN47)

PDB	External Database	Details
Tyr 159	His 159	conflict
Lys 253	-	expression tag
Leu 254	-	expression tag
Ala 255	-	expression tag
Ala 256	-	expression tag
Ala 257	-	expression tag
Leu 258	-	expression tag
Glu 259	-	expression tag
His 260	-	expression tag
His 261	-	expression tag
His 262	-	expression tag
His 263	-	expression tag
His 264	-	expression tag
His 265	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	29208.2
Non-Polymers*	Number of molecules	11
	Total formula weight	1889.7
All*	Total formula weight	31097.9

*Water molecules are not included.