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PISA Interface List.

Session Map (id=978-DM-1IK)

Interfaces in PDB 2qk5 crystal.
Space symmetry group: P 21 21 21. Resolution: 2.20 Å

STRUCTURE OF BACE1 BOUND TO SCH626485

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	`75`	`19`	`16489`	`◊`	A	x-1/2,-y+1/2,-z+1	`4_456`	`77`	`20`	`17338`	`696.6`	`-3.0`	`0.454`	`10`	`0`	`0`	`0.000`
2	`2`		[CS5]B:1	`41`	`1`	`817`	`f`	B	x,y,z	`1_555`	`87`	`34`	`16489`	`599.0`	`1.1`	`0.402`	`10`	`0`	`0`	`0.100`
	`3`		[CS5]A:1	`41`	`1`	`819`	`f`	A	x,y,z	`1_555`	`86`	`33`	`17338`	`589.3`	`0.9`	`0.382`	`11`	`0`	`0`	`0.100`
	*Average:*													`594.1`	`1.0`	`0.392`	`11`	`0`	`0`	`0.100`
3	`4`		A	`42`	`17`	`17338`	`◊`	B	-x,y-1/2,-z+1/2	`3_545`	`59`	`21`	`16489`	`475.6`	`-2.0`	`0.430`	`4`	`1`	`0`	`0.000`
	`5`		A	`60`	`22`	`17338`	`◊`	B	-x+1,y-1/2,-z+1/2	`3_645`	`47`	`19`	`16489`	`469.2`	`-0.9`	`0.476`	`4`	`1`	`0`	`0.000`
	*Average:*													`472.4`	`-1.4`	`0.453`	`4`	`1`	`0`	`0.000`
4	`6`		A	`38`	`11`	`17338`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`45`	`13`	`17338`	`401.7`	`-2.9`	`0.345`	`7`	`3`	`0`	`0.000`
5	`7`		B	`31`	`9`	`16489`	`◊`	A	x,y,z	`1_555`	`23`	`8`	`17338`	`183.5`	`2.1`	`0.807`	`2`	`2`	`0`	`0.000`
6	`8`		A	`7`	`2`	`17338`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`6`	`2`	`17338`	`83.1`	`-2.1`	`0.077`	`0`	`0`	`0`	`0.000`
	`9`		B	`7`	`2`	`16489`	`x`	B	-x+1/2,-y+1,z-1/2	`2_564`	`6`	`2`	`16489`	`75.1`	`-2.3`	`0.053`	`0`	`0`	`0`	`0.000`
	*Average:*													`79.1`	`-2.2`	`0.065`	`0`	`0`	`0`	`0.000`
7	`10`		A	`11`	`5`	`17338`	`◊`	B	-x+1/2,-y,z-1/2	`2_554`	`8`	`3`	`16489`	`67.1`	`1.8`	`0.867`	`2`	`1`	`0`	`0.000`
8	`11`		B	`1`	`1`	`16489`	`x`	B	x-1/2,-y+1/2,-z+1	`4_456`	`1`	`1`	`16489`	`10.7`	`-0.1`	`0.380`	`0`	`0`	`0`	`0.000`

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