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PISA Interface List.

Session Map (id=332-04-DN8)

Interfaces in PDB 3agl crystal.
Space symmetry group: P 21 21 21. Resolution: 2.10 Å

COMPLEX OF PKA WITH THE BISUBSTRATE PROTEIN KINASE INHIBITOR ARC-1039

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		[A03]A:351	`57`	`1`	`1270`	`f`	A	x,y,z	`1_555`	`100`	`40`	`16454`	`770.2`	`1.3`	`0.605`	`10`	`0`	`0`	`0.100`
	`2`		[A03]B:351	`56`	`1`	`1278`	`f`	B	x,y,z	`1_555`	`98`	`37`	`16068`	`742.8`	`-0.5`	`0.454`	`9`	`0`	`0`	`0.100`
	*Average:*													`756.5`	`0.4`	`0.529`	`10`	`0`	`0`	`0.100`
2	`3`		B	`66`	`16`	`16068`	`◊`	A	x-1/2,-y+1/2,-z	`4_455`	`62`	`17`	`16454`	`575.1`	`2.7`	`0.781`	`8`	`7`	`0`	`0.000`
	`4`		A	`62`	`17`	`16454`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`52`	`16`	`16068`	`487.4`	`-0.0`	`0.619`	`3`	`8`	`0`	`0.000`
	*Average:*													`531.2`	`1.4`	`0.700`	`6`	`8`	`0`	`0.000`
3	`5`		B	`31`	`11`	`16068`	`◊`	A	x,y,z	`1_555`	`30`	`9`	`16454`	`298.1`	`1.3`	`0.640`	`5`	`4`	`0`	`0.000`
4	`6`		A	`26`	`14`	`16454`	`◊`	B	-x,y-1/2,-z-1/2	`3_544`	`21`	`9`	`16068`	`229.2`	`5.1`	`0.949`	`5`	`6`	`0`	`0.000`
5	`7`		B	`26`	`10`	`16068`	`x`	B	-x,y-1/2,-z-1/2	`3_544`	`26`	`9`	`16068`	`200.1`	`2.4`	`0.823`	`3`	`0`	`0`	`0.000`
6	`8`		B	`18`	`6`	`16068`	`x`	B	-x-1/2,-y+1,z-1/2	`2_464`	`16`	`5`	`16068`	`150.2`	`3.1`	`0.883`	`4`	`4`	`0`	`0.000`
7	`9`		B	`20`	`4`	`16068`	`◊`	A	-x-1/2,-y+1,z-1/2	`2_464`	`14`	`5`	`16454`	`126.9`	`-1.2`	`0.301`	`1`	`0`	`0`	`0.000`
8	`10`		B	`11`	`4`	`16068`	`◊`	A	-x-1/2,-y,z-1/2	`2_454`	`14`	`7`	`16454`	`123.8`	`0.4`	`0.557`	`2`	`2`	`0`	`0.000`
9	`11`		[A03]B:351	`10`	`1`	`1278`	`◊`	A	x-1/2,-y+1/2,-z	`4_455`	`11`	`3`	`16454`	`90.1`	`0.5`	`0.615`	`0`	`0`	`0`	`0.000`
	`12`		[A03]A:351	`3`	`1`	`1270`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`5`	`2`	`16068`	`48.8`	`0.2`	`0.552`	`1`	`0`	`0`	`0.000`
	*Average:*													`69.4`	`0.4`	`0.584`	`1`	`0`	`0`	`0.000`
10	`13`		A	`10`	`4`	`16454`	`x`	A	-x-1/2,-y,z-1/2	`2_454`	`9`	`2`	`16454`	`72.3`	`0.5`	`0.695`	`1`	`1`	`0`	`0.000`

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

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