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PISA Interface List.

Session Map (id=636-97-42P)

Interfaces in PDB 3k5d crystal.
Space symmetry group: P 1 21 1. Resolution: 2.90 Å

CRYSTAL STRUCTURE OF BACE-1 IN COMPLEX WITH AHM178

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	`99`	`29`	`16052`	`◊`	A	x,y,z	`1_555`	`98`	`31`	`16058`	`905.2`	`-3.0`	`0.519`	`10`	`4`	`0`	`0.000`
2	`2`		[XLI]C:393	`36`	`1`	`868`	`f`	C	x,y,z	`1_555`	`84`	`34`	`16223`	`613.3`	`-13.4`	`0.664`	`11`	`0`	`0`	`0.100`
	`3`		[XLI]A:393	`35`	`1`	`868`	`f`	A	x,y,z	`1_555`	`86`	`34`	`16058`	`599.5`	`-14.1`	`0.584`	`11`	`0`	`0`	`0.100`
	`4`		[XLI]B:393	`35`	`1`	`863`	`f`	B	x,y,z	`1_555`	`84`	`34`	`16052`	`595.9`	`-13.8`	`0.597`	`11`	`0`	`0`	`0.100`
	*Average:*													`602.9`	`-13.8`	`0.615`	`11`	`0`	`0`	`0.100`
3	`5`		A	`40`	`13`	`16058`	`◊`	C	-x,y-1/2,-z+1	`2_546`	`40`	`14`	`16223`	`410.9`	`-7.4`	`0.036`	`0`	`0`	`0`	`0.000`
4	`6`		C	`45`	`15`	`16223`	`◊`	A	x,y,z	`1_555`	`53`	`15`	`16058`	`403.8`	`-2.1`	`0.410`	`3`	`1`	`0`	`0.000`
5	`7`		B	`31`	`11`	`16052`	`◊`	C	-x+1,y-1/2,-z+1	`2_646`	`53`	`15`	`16223`	`377.9`	`-2.1`	`0.253`	`4`	`1`	`0`	`0.000`
6	`8`		B	`48`	`13`	`16052`	`◊`	A	-x,y-1/2,-z	`2_545`	`39`	`12`	`16058`	`364.9`	`-1.9`	`0.351`	`3`	`3`	`0`	`0.000`
7	`9`		B	`40`	`10`	`16052`	`◊`	C	-x,y-1/2,-z+1	`2_546`	`44`	`12`	`16223`	`321.2`	`-3.1`	`0.302`	`3`	`3`	`0`	`0.000`
8	`10`		C	`22`	`8`	`16223`	`◊`	A	-x,y-1/2,-z+1	`2_546`	`21`	`7`	`16058`	`191.5`	`-0.5`	`0.558`	`1`	`0`	`0`	`0.000`
9	`11`		B	`8`	`3`	`16052`	`x`	B	-x+1,y-1/2,-z	`2_645`	`9`	`4`	`16052`	`65.5`	`-0.6`	`0.442`	`0`	`0`	`0`	`0.000`

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