9K2B

Structure of ClpP from Staphylococcus aureus in complex with ZY18

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, C, D, E... (A, B, C, D, E...)	ATP-dependent Clp protease proteolytic subunit	polymer	201	22365.4	14	UniProt (A7WZR9) Pfam (PF00574) UniProt (by SIFTS) (Q2G036)	Staphylococcus aureus subsp. aureus Mu3	Endopeptidase Clp
2	AB, BA, DB, EA, HA... (M, E, N, F, G...)	MAGNESIUM ION	non-polymer		24.3	14	Chemie (MG) PubChem (888)
3	BB, CA, EB, FA, IA... (M, E, N, F, G...)	(4S)-2-METHYL-2,4-PENTANEDIOL	non-polymer		118.2	16	Chemie (MPD) PubChem (5288834)
4	AA, CB, DA, FB, GA... (D, M, E, N, F...)	(6~{S},9~{a}~{S})-6-[(2~{S})-butan-2-yl]-~{N}-[(2~{S})-2-methylbutyl]-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-3,6,9,9~{a}-tetrahydro-2~{H}-pyrazino[1,2-a]pyrimidine-1-carboxamide	non-polymer		478.6	14	Chemie (A1EEL) PubChem (172655004)
5	GB, HB, IB, JB, KB... (A, B, C, D, E...)	water	water		18.0	224	Chemie (HOH)

Sequence modifications

A, B, C, D, E, F, G, H, I, J, K, L, M, N: 1 - 195 (UniProt: A7WZR9)

PDB	External Database	Details
His 196	-	expression tag
His 197	-	expression tag
His 198	-	expression tag
His 199	-	expression tag
His 200	-	expression tag
His 201	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	14
	Total formula weight	313115.8
Non-Polymers*	Number of molecules	44
	Total formula weight	8931.8
All*	Total formula weight	322047.6

*Water molecules are not included.