5A6A

GH20C, Beta-hexosaminidase from Streptococcus pneumoniae in complex with NGT

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)	N-ACETYL-BETA-D-GLUCOSAMINIDASE	polymer	649	74181.5	2	UniProt (C1CH75) Pfam (PF18229) Pfam (PF00728) Pfam (PF18088) UniProt (by SIFTS) (A0A0H2US73)	STREPTOCOCCUS PNEUMONIAE	GH20C
2	C (A)	1,2-ETHANEDIOL	non-polymer		62.1	1	Chemie (EDO)
3	D, E (A, B)	3AR,5R,6S,7R,7AR-5-HYDROXYMETHYL-2-METHYL-5,6,7,7A-TETRAHYDRO-3AH-PYRANO[3,2-D]THIAZOLE-6,7-DIOL	non-polymer		219.3	2	Chemie (NGT)
4	F, G (A, B)	water	water		18.0	79	Chemie (HOH)

Sequence modifications

A, B: 1 - 626 (UniProt: C1CH75)

PDB	External Database	Details
Met -22	-	expression tag
Gly -21	-	expression tag
Ser -20	-	expression tag
Ser -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
Ser -12	-	expression tag
Ser -11	-	expression tag
Gly -10	-	expression tag
Leu -9	-	expression tag
Val -8	-	expression tag
Pro -7	-	expression tag
Arg -6	-	expression tag
Gly -5	-	expression tag
Ser -4	-	expression tag
His -3	-	expression tag
Met -2	-	expression tag
Ala -1	-	expression tag
Ser 0	-	expression tag
Leu 9	Pro 9	conflict
Val 158	Met 158	conflict

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	148363.0
Non-Polymers*	Number of molecules	3
	Total formula weight	500.6
All*	Total formula weight	148863.6

*Water molecules are not included.