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PDBePISA

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PISA Interface List.

Session Map (id=584-H2-JFG)

Interfaces in PDB 4x0m crystal.
Space symmetry group: P 21 21 21. Resolution: 1.68 Å

SELECTION OF FRAGMENTS FOR KINASE INHIBITOR DESIGN: DECORATION IS KEY

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	`91`	`26`	`14507`	`x`	A	x-1/2,-y+3/2,-z	`4_465`	`93`	`24`	`14507`	`826.4`	`-6.2`	`0.233`	`12`	`1`	`0`	`0.000`
`2`		A	`43`	`12`	`14507`	`x`	A	-x+1,y-1/2,-z+1/2	`3_645`	`48`	`13`	`14507`	`411.4`	`-1.2`	`0.459`	`4`	`2`	`0`	`0.000`
`3`		A	`36`	`12`	`14507`	`x`	A	-x+1/2,-y+2,z-1/2	`2_574`	`42`	`15`	`14507`	`314.3`	`2.6`	`0.701`	`5`	`4`	`0`	`0.000`
`4`		A	`31`	`10`	`14507`	`x`	A	x-1,y,z	`1_455`	`39`	`11`	`14507`	`310.9`	`-2.1`	`0.261`	`2`	`0`	`0`	`0.000`
`5`		[3WA]A:601	`12`	`1`	`296`	`f`	A	x,y,z	`1_555`	`29`	`16`	`14507`	`204.4`	`0.2`	`0.331`	`2`	`0`	`0`	`0.003`
`6`		A	`14`	`4`	`14507`	`x`	A	x-1/2,-y+5/2,-z	`4_475`	`14`	`7`	`14507`	`116.6`	`-1.3`	`0.304`	`1`	`0`	`0`	`0.000`
`7`		[SO4]A:602	`5`	`1`	`186`	`f`	A	x,y,z	`1_555`	`17`	`8`	`14507`	`115.3`	`-16.8`	`0.682`	`4`	`0`	`0`	`0.097`
`8`		A	`3`	`1`	`14507`	`◊`	[SO4]A:602	x-1,y,z	`1_455`	`4`	`1`	`186`	`20.9`	`-2.2`	`0.832`	`0`	`0`	`0`	`0.000`
`9`		A	`1`	`1`	`14507`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`1`	`1`	`14507`	`3.4`	`-0.1`	`0.386`	`0`	`0`	`0`	`0.000`

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