3OMJ

Structural Basis for Cyclic Py-Im Polyamide Allosteric Inhibition of Nuclear Receptor Binding

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)	5'-D(*CP*(C38)P*AP*GP*TP*AP*CP*TP*GP*G)-3'	polymer	10	3170.9	2
2	C, D, E, G (A, B)	CALCIUM ION	non-polymer		40.1	4	Chemie (CA)
3	F (B)	(23R,52R)-23,52-diamino-5,11,17,28,34,40,46,57-octamethyl-2,5,8,11,14,17,20,25,28,31,34,37,40,43,46,49,54,57,60,64-icosaazanonacyclo[54.2.1.1~4,7~.1~10,13~.1~16,19~.1~27,30~.1~33,36~.1~39,42~.1~45,48~]hexahexaconta-1(58),4(66),6,10(65),12,16(64),18,27(63),29,33(62),35,39(61),41,45(60),47,56(59)-hexadecaene-3,9,15,21,26,32,38,44,50,55-decone	non-polymer		1179.2	1	Chemie (1P2)
4	H, I (A, B)	water	water		18.0	237	Chemie (HOH)

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	6341.8
Non-Polymers*	Number of molecules	5
	Total formula weight	1339.5
All*	Total formula weight	7681.3

*Water molecules are not included.