PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=356-91-C2M)

Interfaces in PDB 4r91 crystal.
Space symmetry group: P 21 21 21. Resolution: 1.58 Å

BACE-1 IN COMPLEX WITH (R)-4-(2-CYCLOHEXYLETHYL)-4-(((1S,3R)-3- (CYCLOPENTYLAMINO)CYCLOHEXYL)METHYL)-1-METHYL-5-OXOIMIDAZOLIDIN-2- IMINIUM

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	`79`	`20`	`16243`	`◊`	A	x-1/2,-y+1/2,-z+1	`4_456`	`82`	`20`	`16450`	`723.1`	`-1.1`	`0.674`	`12`	`0`	`0`	`0.000`
2	`2`		A	`60`	`23`	`16450`	`◊`	B	-x+1,y-1/2,-z+1/2	`3_645`	`49`	`16`	`16243`	`506.8`	`-1.8`	`0.502`	`3`	`1`	`0`	`0.000`
	`3`		A	`50`	`16`	`16450`	`◊`	B	-x,y-1/2,-z+1/2	`3_545`	`61`	`23`	`16243`	`502.5`	`-2.0`	`0.480`	`3`	`1`	`0`	`0.000`
	*Average:*													`504.7`	`-1.9`	`0.491`	`3`	`1`	`0`	`0.000`
3	`4`		[3KT]B:502	`26`	`1`	`653`	`f`	B	x,y,z	`1_555`	`66`	`27`	`16243`	`458.3`	`0.5`	`0.561`	`2`	`0`	`0`	`0.052`
	`5`		[3KT]A:502	`26`	`1`	`652`	`f`	A	x,y,z	`1_555`	`66`	`27`	`16450`	`451.1`	`0.5`	`0.572`	`2`	`0`	`0`	`0.052`
	*Average:*													`454.7`	`0.5`	`0.566`	`2`	`0`	`0`	`0.052`
4	`6`		B	`34`	`11`	`16243`	`◊`	A	x,y,z	`1_555`	`23`	`9`	`16450`	`241.9`	`1.7`	`0.824`	`1`	`3`	`0`	`0.000`
5	`7`		A	`14`	`5`	`16450`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`15`	`4`	`16450`	`133.6`	`-2.1`	`0.207`	`1`	`0`	`0`	`0.000`
6	`8`		[TLA]A:501	`9`	`1`	`271`	`f`	A	x,y,z	`1_555`	`18`	`8`	`16450`	`126.1`	`2.7`	`0.813`	`7`	`0`	`0`	`0.070`
	`9`		[TLA]B:501	`9`	`1`	`271`	`f`	B	x,y,z	`1_555`	`17`	`8`	`16243`	`125.9`	`2.1`	`0.771`	`7`	`0`	`0`	`0.070`
	*Average:*													`126.0`	`2.4`	`0.792`	`7`	`0`	`0`	`0.070`
7	`10`		A	`11`	`3`	`16450`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`6`	`2`	`16450`	`79.2`	`-2.4`	`0.084`	`0`	`0`	`0`	`0.000`
	`11`		B	`9`	`3`	`16243`	`x`	B	-x+1/2,-y+1,z-1/2	`2_564`	`6`	`2`	`16243`	`76.7`	`-2.3`	`0.074`	`0`	`0`	`0`	`0.000`
	*Average:*													`77.9`	`-2.3`	`0.079`	`0`	`0`	`0`	`0.000`
8	`12`		A	`6`	`2`	`16450`	`◊`	B	-x+1/2,-y,z-1/2	`2_554`	`5`	`2`	`16243`	`46.6`	`1.2`	`0.870`	`1`	`0`	`0`	`0.000`
9	`13`		B	`1`	`1`	`16243`	`x`	B	x-1/2,-y+1/2,-z+1	`4_456`	`1`	`1`	`16243`	`13.8`	`-0.1`	`0.349`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank
in Europe