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PISA Interface List.

Session Map (id=245-7H-1N5)

Interfaces in PDB 2q11 crystal.
Space symmetry group: C 1 2 1. Resolution: 2.40 Å

STRUCTURE OF BACE COMPLEXED TO COMPOUND 1

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`		B	`87`	`22`	`16753`	`◊`	C	-x+3/2,y-1/2,-z	`4_645`	`82`	`22`	`16753`	`750.5`	`-3.0`	`0.540`	`11`	`0`	`0`	`0.000`
	`2`		A	`78`	`22`	`16760`	`◊`	A	-x+2,y,-z+1	`2_756`	`77`	`22`	`16760`	`729.5`	`-2.1`	`0.583`	`14`	`0`	`0`	`0.000`
	*Average:*													`740.0`	`-2.6`	`0.562`	`13`	`0`	`0`	`0.000`
2	`3`		C	`66`	`20`	`16753`	`◊`	A	x,y,z	`1_555`	`64`	`16`	`16760`	`597.4`	`0.1`	`0.312`	`6`	`0`	`0`	`0.000`
	`4`		B	`63`	`15`	`16753`	`◊`	A	x,y,z	`1_555`	`64`	`20`	`16760`	`589.1`	`2.0`	`0.588`	`5`	`0`	`0`	`0.000`
	*Average:*													`593.2`	`1.1`	`0.450`	`6`	`0`	`0`	`0.000`
3	`5`		B	`59`	`19`	`16753`	`◊`	B	-x+2,y,-z	`2_755`	`59`	`19`	`16753`	`473.8`	`-0.6`	`0.677`	`4`	`0`	`0`	`0.000`
4	`6`		[XX4]A:501	`25`	`1`	`586`	`f`	A	x,y,z	`1_555`	`58`	`23`	`16760`	`412.7`	`-5.3`	`0.393`	`3`	`0`	`0`	`0.100`
	`7`		[XX4]C:503	`27`	`1`	`594`	`f`	C	x,y,z	`1_555`	`55`	`22`	`16753`	`405.3`	`-5.1`	`0.402`	`4`	`0`	`0`	`0.100`
	`8`		[XX4]B:502	`26`	`1`	`592`	`f`	B	x,y,z	`1_555`	`53`	`24`	`16753`	`403.6`	`-4.8`	`0.414`	`3`	`0`	`0`	`0.100`
	*Average:*													`407.2`	`-5.1`	`0.403`	`3`	`0`	`0`	`0.100`
5	`9`		C	`27`	`7`	`16753`	`◊`	A	-x+3/2,y-1/2,-z+1	`4_646`	`36`	`11`	`16760`	`229.2`	`-1.6`	`0.475`	`0`	`0`	`0`	`0.000`
6	`10`		B	`17`	`4`	`16753`	`◊`	C	x,y,z-1	`1_554`	`18`	`6`	`16753`	`141.6`	`0.0`	`0.600`	`1`	`0`	`0`	`0.000`
7	`11`		C	`11`	`4`	`16753`	`◊`	A	-x+3/2,y-1/2,-z	`4_645`	`9`	`4`	`16760`	`89.1`	`-2.0`	`0.146`	`0`	`0`	`0`	`0.000`
8	`12`		C	`1`	`1`	`16753`	`x`	C	-x+3/2,y-1/2,-z+1	`4_646`	`1`	`1`	`16753`	`1.6`	`0.1`	`0.772`	`0`	`0`	`0`	`0.000`

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