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PISA Interface List.

Session Map (id=361-9A-238)

Interfaces in PDB 6uj1 crystal.
Space symmetry group: P 31 2 1. Resolution: 3.03 Å

BACE2 MUTANT IN COMPLEX WITH A MACROCYCLIC COMPOUND

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`		[L3M]A:401	`44`	`1`	`864`	`f`	A	x,y,z	`1_555`	`88`	`35`	`15497`	`633.7`	`-10.9`	`0.476`	`11`	`0`	`0`	`0.100`
	`2`		[L3M]B:401	`43`	`1`	`854`	`f`	B	x,y,z	`1_555`	`85`	`35`	`15181`	`626.7`	`-9.8`	`0.544`	`8`	`0`	`0`	`0.100`
	*Average:*													`630.2`	`-10.4`	`0.510`	`10`	`0`	`0`	`0.100`
2	`3`		A	`61`	`19`	`15497`	`◊`	A	-x,-x+y,-z+1/3	`6_555`	`61`	`19`	`15497`	`594.5`	`-3.2`	`0.411`	`12`	`2`	`0`	`0.000`
3	`4`		B	`54`	`17`	`15181`	`◊`	B	y,x,-z	`4_555`	`54`	`17`	`15181`	`536.4`	`-4.0`	`0.354`	`4`	`10`	`0`	`0.000`
	`5`		A	`42`	`14`	`15497`	`◊`	A	y,x,-z	`4_555`	`42`	`14`	`15497`	`439.9`	`-6.3`	`0.088`	`1`	`0`	`0`	`0.000`
	*Average:*													`488.1`	`-5.2`	`0.221`	`3`	`5`	`0`	`0.000`
4	`6`		A	`55`	`16`	`15497`	`◊`	B	-y-1,x-y-1,z+1/3	`2_445`	`65`	`19`	`15181`	`526.1`	`-5.1`	`0.277`	`8`	`0`	`0`	`0.000`
5	`7`		B	`48`	`13`	`15181`	`◊`	A	-y-1,x-y-1,z+1/3	`2_445`	`51`	`15`	`15497`	`466.6`	`0.4`	`0.721`	`5`	`6`	`0`	`0.000`
6	`8`		B	`40`	`17`	`15181`	`◊`	A	x,y,z	`1_555`	`50`	`20`	`15497`	`403.7`	`-1.8`	`0.509`	`5`	`0`	`0`	`0.000`
7	`9`		B	`31`	`8`	`15181`	`◊`	A	y,x-1,-z	`4_545`	`44`	`18`	`15497`	`354.6`	`0.3`	`0.596`	`6`	`0`	`0`	`0.000`
8	`10`		B	`31`	`10`	`15181`	`◊`	A	-x-1,-x+y-1,-z+1/3	`6_445`	`26`	`6`	`15497`	`230.9`	`0.7`	`0.678`	`4`	`1`	`0`	`0.000`
9	`11`		B	`20`	`6`	`15181`	`x`	B	-y-1,x-y-1,z+1/3	`2_445`	`20`	`9`	`15181`	`158.7`	`0.6`	`0.713`	`0`	`1`	`0`	`0.000`
10	`12`		A	`11`	`5`	`15497`	`x`	A	-y-1,x-y-1,z+1/3	`2_445`	`6`	`3`	`15497`	`63.4`	`1.0`	`0.803`	`1`	`0`	`0`	`0.000`
11	`13`		B	`1`	`1`	`15181`	`◊`	A	y,x,-z	`4_555`	`1`	`1`	`15497`	`0.6`	`0.0`	`0.683`	`0`	`0`	`0`	`0.000`

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