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PISA Interface List.

Session Map (id=214-G2-3PH)

Interfaces in PDB 3qkl crystal.
Space symmetry group: P 1 21 1. Resolution: 1.90 Å

SPIROCHROMANE AKT INHIBITORS

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`		C	`55`	`10`	`1467`	`◊`	A	x,y,z	`1_555`	`79`	`30`	`15449`	`632.4`	`-0.1`	`0.468`	`13`	`8`	`0`	`0.054`
`2`		[SMR]A:1	`36`	`1`	`770`	`f`	A	x,y,z	`1_555`	`79`	`31`	`15449`	`526.5`	`-2.7`	`0.330`	`7`	`0`	`0`	`0.100`
`3`		A	`51`	`12`	`15449`	`x`	A	-x,y-1/2,-z+1	`2_546`	`60`	`14`	`15449`	`512.7`	`-1.1`	`0.475`	`9`	`4`	`0`	`0.000`
`4`		A	`24`	`8`	`15449`	`x`	A	-x,y-1/2,-z	`2_545`	`21`	`5`	`15449`	`206.2`	`0.4`	`0.620`	`3`	`0`	`0`	`0.000`
`5`		A	`20`	`8`	`15449`	`x`	A	x-1,y,z	`1_455`	`21`	`8`	`15449`	`191.6`	`1.3`	`0.704`	`0`	`0`	`0`	`0.000`
`6`		C	`6`	`3`	`1467`	`◊`	A	x-1,y,z	`1_455`	`6`	`3`	`15449`	`60.3`	`-1.6`	`0.219`	`0`	`0`	`0`	`0.000`
`7`		A	`6`	`3`	`15449`	`x`	A	-x+1,y-1/2,-z+1	`2_646`	`3`	`2`	`15449`	`43.0`	`-0.5`	`0.330`	`0`	`0`	`0`	`0.000`
`8`		A	`3`	`1`	`15449`	`◊`	C	-x,y-1/2,-z+1	`2_546`	`5`	`1`	`1467`	`35.8`	`0.7`	`0.757`	`1`	`2`	`0`	`0.000`
`9`		[SMR]A:1	`2`	`1`	`770`	`◊`	C	x,y,z	`1_555`	`2`	`1`	`1467`	`17.1`	`-0.4`	`0.447`	`0`	`0`	`0`	`0.003`

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