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PISA Interface List.

Session Map (id=438-I1-74P)

Interfaces in PDB 3qpp crystal.
Space symmetry group: H 3. Resolution: 1.80 Å

STRUCTURE OF PDE10-INHIBITOR COMPLEX

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`		A	`61`	`17`	`14454`	`x`	A	-y,x-y,z	`2_555`	`63`	`20`	`14454`	`645.2`	`-7.3`	`0.151`	`5`	`0`	`0`	`0.113`
`2`		[PFW]A:999	`37`	`1`	`728`	`f`	A	x,y,z	`1_555`	`64`	`27`	`14454`	`482.2`	`-8.1`	`0.151`	`3`	`0`	`0`	`0.112`
`3`		A	`50`	`17`	`14454`	`x`	A	-y+2/3,x-y+1/3,z+1/3	`5_555`	`45`	`20`	`14454`	`453.8`	`-3.9`	`0.313`	`3`	`2`	`0`	`0.000`
`4`		[DMS]A:900	`4`	`1`	`208`	`f`	A	x,y,z	`1_555`	`17`	`9`	`14454`	`115.2`	`1.5`	`0.426`	`0`	`0`	`0`	`0.000`
`5`		[DMS]A:901	`4`	`1`	`207`	`◊`	A	x,y,z	`1_555`	`16`	`7`	`14454`	`109.5`	`1.8`	`0.482`	`0`	`0`	`0`	`0.000`
`6`		A	`10`	`2`	`14454`	`◊`	[PFW]A:999	-y+2/3,x-y+1/3,z+1/3	`5_555`	`8`	`1`	`728`	`79.1`	`-0.5`	`0.590`	`0`	`0`	`0`	`0.000`
`7`		[SO4]A:997	`5`	`1`	`185`	`f`	A	-y,x-y,z	`2_555`	`15`	`4`	`14454`	`72.3`	`-10.2`	`0.697`	`3`	`0`	`0`	`0.136`
`8`		[SO4]A:997	`4`	`1`	`185`	`◊`	A	x,y,z	`1_555`	`4`	`2`	`14454`	`59.7`	`-6.6`	`0.970`	`5`	`0`	`0`	`0.104`
`9`		[MG]A:2	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`16`	`9`	`14454`	`59.0`	`-9.0`	`0.000`	`0`	`0`	`0`	`0.106`
`10`		A	`7`	`3`	`14454`	`f`	[DMS]A:901	-y,x-y,z	`2_555`	`3`	`1`	`207`	`49.0`	`1.0`	`0.364`	`0`	`0`	`0`	`0.000`
`11`		[ZN]A:1	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`5`	`3`	`14454`	`42.8`	`-33.3`	`0.000`	`0`	`0`	`0`	`0.393`
`12`		[MG]A:2	`1`	`1`	`98`	`f`	[ZN]A:1	x,y,z	`1_555`	`1`	`1`	`98`	`15.1`	`-7.4`	`0.000`	`0`	`0`	`0`	`0.087`

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