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PISA Interface List.

Session Map (id=278-9P-M92)

Interfaces in PDB 4z0k crystal.
Space symmetry group: H 3. Resolution: 1.41 Å

RAPID DEVELOPMENT OF TWO FACTOR IXA INHIBITORS FROM HIT TO LEAD

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`		B	`83`	`19`	`4377`	`◊`	A	x,y,z	`1_555`	`92`	`27`	`11174`	`779.2`	`-9.7`	`0.164`	`8`	`0`	`1`	`0.538`
`2`		B	`56`	`16`	`4377`	`◊`	A	-y-1/3,x-y-2/3,z+1/3	`5_445`	`49`	`17`	`11174`	`471.1`	`-6.5`	`0.200`	`1`	`0`	`0`	`0.233`
`3`		A	`41`	`13`	`11174`	`x`	A	-y-1,x-y-1,z	`2_445`	`49`	`14`	`11174`	`408.0`	`-0.5`	`0.550`	`0`	`0`	`0`	`0.000`
`4`		[4LN]A:301	`28`	`1`	`614`	`f`	A	x,y,z	`1_555`	`69`	`18`	`11174`	`396.7`	`0.8`	`0.395`	`1`	`0`	`0`	`0.000`
`5`		A	`40`	`11`	`11174`	`x`	A	-x+y-1/3,-x-2/3,z+1/3	`6_445`	`42`	`15`	`11174`	`331.8`	`-2.8`	`0.370`	`0`	`0`	`0`	`0.000`
`6`		B	`19`	`6`	`4377`	`◊`	A	-x+y-1/3,-x-2/3,z+1/3	`6_445`	`27`	`9`	`11174`	`213.3`	`-0.7`	`0.553`	`1`	`0`	`0`	`0.000`
`7`		[NHE]A:303	`13`	`1`	`371`	`◊`	A	x,y,z	`1_555`	`25`	`10`	`11174`	`162.1`	`3.3`	`0.130`	`2`	`0`	`0`	`0.000`
`8`		A	`7`	`2`	`11174`	`f`	[NHE]A:303	-x+y-1/3,-x-2/3,z+1/3	`6_445`	`9`	`1`	`371`	`86.1`	`1.6`	`0.067`	`0`	`0`	`0`	`0.000`
`9`		B	`9`	`5`	`4377`	`x`	B	-y-1/3,x-y-2/3,z+1/3	`5_445`	`11`	`4`	`4377`	`68.2`	`-1.3`	`0.386`	`0`	`0`	`0`	`0.000`
`10`		[NA]A:302	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`6`	`5`	`11174`	`63.4`	`-12.1`	`0.000`	`0`	`0`	`0`	`0.408`
`11`		A	`8`	`3`	`11174`	`x`	A	-y-1/3,x-y-2/3,z+1/3	`5_445`	`9`	`2`	`11174`	`51.8`	`-0.3`	`0.488`	`1`	`1`	`0`	`0.000`
`12`		[CL]B:201	`1`	`1`	`125`	`f`	A	-y-1/3,x-y-2/3,z+1/3	`5_445`	`8`	`4`	`11174`	`49.3`	`-6.4`	`0.000`	`0`	`0`	`0`	`0.215`
`13`		[CL]B:201	`1`	`1`	`125`	`◊`	B	x,y,z	`1_555`	`7`	`3`	`4377`	`46.0`	`-6.2`	`0.000`	`0`	`0`	`0`	`0.208`
`14`		B	`8`	`2`	`4377`	`◊`	[NHE]A:303	-x+y-1/3,-x-2/3,z+1/3	`6_445`	`4`	`1`	`371`	`43.1`	`1.8`	`0.388`	`0`	`0`	`0`	`0.000`
`15`		[4LN]A:301	`2`	`1`	`614`	`◊`	A	-y-1,x-y-1,z	`2_445`	`2`	`1`	`11174`	`23.6`	`0.4`	`0.603`	`0`	`0`	`0`	`0.000`

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