2Y30

Simocyclinone D8 bound form of TetR-like repressor SimR

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B	PUTATIVE REPRESSOR SIMREG2	polymer	267	30240.2	2	UniProt (Q9AMH9) Pfam (PF00440) Pfam (PF02909) In PDB	STREPTOMYCES ANTIBIOTICUS	SIMR, SIM16
2	A, B	SIMOCYCLINONE D8	non-polymer		932.3	2	Chemie (SM8)
3	A, B	CHLORIDE ION	non-polymer		35.5	6	Chemie (CL)
4		water	water		18.0	164	Chemie (HOH)

Sequence modifications

A, B: 1 - 259 (UniProt: Q9AMH9)

PDB	External Database	Details
Leu 260	-	expression tag
Glu 261	-	expression tag
His 262	-	expression tag
His 263	-	expression tag
His 264	-	expression tag
His 265	-	expression tag
His 266	-	expression tag
His 267	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	60480.4
Non-Polymers*	Number of molecules	8
	Total formula weight	2077.3
All*	Total formula weight	62557.7

*Water molecules are not included.