PDBe < PISA < EMBL-EBI

PISA Interface List.

Interfaces in PDB 4acu crystal.
Space symmetry group: P 21 21 21. Resolution: 1.75 Å

AMINOIMIDAZOLES AS BACE-1 INHIBITORS. X-RAY CRYSTAL STRUCTURE OF BETA SECRETASE COMPLEXED WITH COMPOUND 14

Interfaces

##		Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
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`		[QN7]A:1506	`29`	`1`	`642`	`f`	A	x,y,z	`1_555`	`62`	`25`	`16172`	`417.4`	`5.5`	`0.381`	`5`	`0`	`0`	`0.000`
`2`		A	`37`	`13`	`16172`	`x`	A	-x,y-1/2,-z-1/2	`3_544`	`47`	`16`	`16172`	`360.4`	`-1.1`	`0.530`	`6`	`6`	`0`	`0.000`
`3`		A	`24`	`8`	`16172`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`30`	`7`	`16172`	`300.7`	`-3.3`	`0.201`	`4`	`0`	`0`	`0.000`
`4`		A	`36`	`13`	`16172`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`34`	`9`	`16172`	`298.5`	`1.2`	`0.748`	`4`	`1`	`0`	`0.000`
`5`		A	`27`	`7`	`16172`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`24`	`9`	`16172`	`208.5`	`-1.9`	`0.372`	`3`	`0`	`0`	`0.000`
`6`		A	`22`	`9`	`16172`	`x`	A	-x-1/2,-y,z-1/2	`2_454`	`23`	`10`	`16172`	`206.1`	`0.6`	`0.636`	`5`	`0`	`0`	`0.000`
`7`		[ACT]A:1504	`4`	`1`	`183`	`f`	A	x,y,z	`1_555`	`16`	`10`	`16172`	`111.2`	`-0.6`	`0.576`	`2`	`0`	`0`	`0.280`
`8`		[ACT]A:1503	`4`	`1`	`182`	`f`	A	x,y,z	`1_555`	`17`	`7`	`16172`	`99.5`	`-0.4`	`0.620`	`1`	`0`	`0`	`0.163`
`9`		[ACT]A:1505	`4`	`1`	`183`	`f`	A	x,y,z	`1_555`	`12`	`4`	`16172`	`75.9`	`-0.9`	`0.559`	`0`	`0`	`0`	`0.171`
`10`		[QN7]A:1506	`9`	`1`	`642`	`f`	[ACT]A:1503	x,y,z	`1_555`	`4`	`1`	`182`	`54.3`	`-0.6`	`0.252`	`0`	`0`	`0`	`0.106`
`11`		A	`2`	`2`	`16172`	`x`	A	x-1,y,z	`1_455`	`3`	`2`	`16172`	`22.7`	`0.4`	`0.390`	`0`	`0`	`0`	`0.000`
`12`		[ACT]A:1504	`1`	`1`	`183`	`◊`	A	-x+1/2,-y,z-1/2	`2_554`	`2`	`1`	`16172`	`9.7`	`0.1`	`0.643`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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