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PISA Interface List.

Session Map (id=141-H4-D1L)

Interfaces in PDB 5vgy crystal.
Space symmetry group: P 1 21 1. Resolution: 1.39 Å

IDENTIFICATION OF A NEW ZINC BINDING CHEMOTYPE BY FRAGMENT SCREENING

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	`44`	`15`	`11854`	`x`	A	x-1,y,z	`1_455`	`42`	`9`	`11854`	`409.6`	`-1.0`	`0.510`	`5`	`7`	`0`	`0.000`
`2`		A	`39`	`12`	`11854`	`x`	A	-x+1,y-1/2,-z+3	`2_648`	`47`	`17`	`11854`	`391.7`	`2.5`	`0.789`	`4`	`0`	`0`	`0.000`
`3`		A	`33`	`10`	`11854`	`x`	A	-x,y-1/2,-z+2	`2_547`	`28`	`9`	`11854`	`317.8`	`0.6`	`0.584`	`6`	`1`	`0`	`0.000`
`4`		[9AA]A:304	`18`	`1`	`445`	`f`	A	x,y,z	`1_555`	`33`	`17`	`11854`	`279.3`	`1.1`	`0.206`	`4`	`0`	`0`	`0.001`
`5`		A	`34`	`11`	`11854`	`x`	A	x,y-1,z	`1_545`	`32`	`10`	`11854`	`278.7`	`0.4`	`0.635`	`3`	`0`	`0`	`0.000`
`6`		A	`26`	`10`	`11854`	`x`	A	-x+1,y-1/2,-z+2	`2_647`	`34`	`14`	`11854`	`255.5`	`-1.7`	`0.222`	`3`	`1`	`0`	`0.000`
`7`		[NA]A:302	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`10`	`6`	`11854`	`68.4`	`-11.2`	`0.000`	`0`	`0`	`0`	`0.019`
`8`		[NA]A:303	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`8`	`3`	`11854`	`50.8`	`-6.8`	`0.000`	`0`	`0`	`0`	`0.012`
`9`		A	`6`	`3`	`11854`	`◊`	[NA]A:303	-x+1,y-1/2,-z+3	`2_648`	`1`	`1`	`125`	`44.7`	`-5.2`	`0.000`	`0`	`0`	`0`	`0.000`
`10`		[ZN]A:301	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`6`	`4`	`11854`	`35.5`	`-25.4`	`0.000`	`0`	`0`	`0`	`0.044`
`11`		[9AA]A:304	`4`	`1`	`445`	`f`	[ZN]A:301	x,y,z	`1_555`	`1`	`1`	`98`	`31.6`	`-13.6`	`0.000`	`0`	`0`	`0`	`0.024`

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