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PISA Interface List.

Session Map (id=748-08-PC0)

Interfaces in PDB 5bve crystal.
Space symmetry group: P 21 21 21. Resolution: 2.00 Å

TETRAHYDROPYRROLO-DIAZEPENONES AS INHIBITORS OF ERK2 KINASE

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	`62`	`18`	`16681`	`x`	A	x-1,y,z	`1_455`	`68`	`16`	`16681`	`566.9`	`-6.6`	`0.176`	`4`	`0`	`0`	`0.000`
`2`		[4VG]A:401	`33`	`1`	`706`	`f`	A	x,y,z	`1_555`	`74`	`28`	`16681`	`517.6`	`-4.4`	`0.460`	`5`	`0`	`0`	`0.011`
`3`		A	`45`	`17`	`16681`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`46`	`14`	`16681`	`464.6`	`-0.6`	`0.374`	`3`	`0`	`0`	`0.000`
`4`		A	`39`	`10`	`16681`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`38`	`11`	`16681`	`358.0`	`-3.4`	`0.261`	`1`	`1`	`0`	`0.000`
`5`		A	`36`	`9`	`16681`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`30`	`9`	`16681`	`266.3`	`-1.1`	`0.489`	`2`	`1`	`0`	`0.000`
`6`		[SO4]A:405	`5`	`1`	`185`	`f`	A	x,y,z	`1_555`	`17`	`8`	`16681`	`110.6`	`-16.0`	`0.742`	`5`	`0`	`0`	`0.031`
`7`		[SO4]A:404	`5`	`1`	`185`	`f`	A	x,y,z	`1_555`	`10`	`4`	`16681`	`87.2`	`-12.4`	`0.888`	`4`	`0`	`0`	`0.024`
`8`		[SO4]A:403	`5`	`1`	`185`	`f`	A	x,y,z	`1_555`	`14`	`5`	`16681`	`75.4`	`-10.6`	`0.868`	`3`	`0`	`0`	`0.021`
`9`		[SO4]A:402	`4`	`1`	`186`	`f`	A	-x+1/2,-y,z-1/2	`2_554`	`6`	`3`	`16681`	`52.5`	`-6.8`	`0.584`	`1`	`0`	`0`	`0.013`
`10`		[SO4]A:402	`4`	`1`	`186`	`◊`	A	x,y,z	`1_555`	`3`	`2`	`16681`	`44.1`	`-4.7`	`0.822`	`1`	`0`	`0`	`0.000`
`11`		[SO4]A:404	`3`	`1`	`185`	`◊`	A	-x,y-1/2,-z+1/2	`3_545`	`5`	`2`	`16681`	`37.5`	`-4.3`	`0.717`	`2`	`0`	`0`	`0.000`
`12`		A	`4`	`2`	`16681`	`◊`	[SO4]A:402	x-1,y,z	`1_455`	`4`	`1`	`186`	`35.8`	`-3.4`	`0.960`	`1`	`0`	`0`	`0.000`
`13`		A	`1`	`1`	`16681`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`3`	`1`	`16681`	`22.6`	`-0.1`	`0.275`	`0`	`0`	`0`	`0.000`

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