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Interfaces in PDB 5m75 crystal.
Space symmetry group: P 21 21 21. Resolution: 1.54 Å

COCRYSTAL STRUCTURE OF CAMP-DEPENDENT PROTEIN KINASE (PKA) IN COMPLEX WITH A (S)-METHYL SUBSTITUED FASUDIL-DERIVATIVE

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
NN	«»	Range	ⁱN_at	ⁱN_res	Surface Å²	×	Range	Symmetry op-n	Sym.ID	ⁱN_at	ⁱN_res	Surface Å²	interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
`1`		B	`79`	`15`	`2240`	`◊`	A	x,y,z	`1_555`	`108`	`36`	`16549`	`908.0`	`-0.2`	`0.810`	`12`	`18`	`0`	`0.000`
`2`		A	`57`	`18`	`16549`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`46`	`20`	`16549`	`521.4`	`-1.1`	`0.649`	`2`	`0`	`0`	`0.000`
`3`		B	`29`	`10`	`2240`	`◊`	A	-x,y-1/2,-z+1/2	`3_545`	`38`	`13`	`16549`	`339.4`	`-1.5`	`0.577`	`1`	`2`	`0`	`0.000`
`4`		[9K6]A:402	`20`	`1`	`457`	`◊`	A	x,y,z	`1_555`	`44`	`19`	`16549`	`326.0`	`5.7`	`0.487`	`1`	`0`	`0`	`0.000`
`5`		A	`40`	`10`	`16549`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`39`	`10`	`16549`	`316.9`	`-1.9`	`0.594`	`0`	`6`	`0`	`0.000`
`6`		A	`20`	`7`	`16549`	`x`	A	x-1,y,z	`1_455`	`20`	`6`	`16549`	`175.4`	`0.8`	`0.790`	`0`	`1`	`0`	`0.000`
`7`		[DMS]A:401	`4`	`1`	`210`	`◊`	A	x,y,z	`1_555`	`29`	`12`	`16549`	`150.3`	`1.9`	`0.414`	`0`	`0`	`0`	`0.000`
`8`		[DMS]A:401	`1`	`1`	`210`	`f`	A	x-1/2,-y-1/2,-z	`4_445`	`1`	`1`	`16549`	`12.0`	`0.8`	`0.693`	`0`	`0`	`0`	`0.000`
`9`		[9K6]A:402	`1`	`1`	`457`	`f`	B	x,y,z	`1_555`	`2`	`1`	`2240`	`5.8`	`-0.1`	`0.443`	`0`	`0`	`0`	`0.100`
`10`		A	`1`	`1`	`16549`	`x`	A	-x-1,y-1/2,-z+1/2	`3_445`	`1`	`1`	`16549`	`5.1`	`-0.2`	`0.309`	`0`	`0`	`0`	`0.000`
`11`		A	`1`	`1`	`16549`	`◊`	B	x-1,y,z	`1_455`	`1`	`1`	`2240`	`3.9`	`0.1`	`0.772`	`0`	`0`	`0`	`0.000`

PDBe PISA v1.52 [20/10/2014]

Protein Data Bank
in Europe