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PISA Interface List.

Session Map (id=544-I1-I31)

Interfaces in PDB 4j4z crystal.
Space symmetry group: C 1 2 1. Resolution: 1.26 Å

CRYSTAL STRUCTURE OF THE IMPROVED VARIANT OF THE EVOLVED SERINE HYDROLASE, OSH55.4_H1.2, BOND WITH SULFATE ION IN THE ACTIVE SITE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR301

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	`77`	`23`	`8142`	`◊`	A	-x+1,y,-z+2	`2_657`	`77`	`23`	`8142`	`689.8`	`-11.3`	`0.089`	`1`	`0`	`0`	`0.023`
`2`		A	`57`	`17`	`8142`	`x`	A	-x+1/2,y-1/2,-z+2	`4_547`	`62`	`14`	`8142`	`527.6`	`-3.6`	`0.441`	`1`	`4`	`0`	`0.000`
`3`		[EPE]A:206	`14`	`1`	`401`	`f`	A	x,y,z	`1_555`	`28`	`12`	`8142`	`194.5`	`2.8`	`0.038`	`1`	`0`	`0`	`0.000`
`4`		A	`17`	`9`	`8142`	`x`	A	x,y,z-1	`1_554`	`22`	`8`	`8142`	`142.9`	`0.5`	`0.687`	`1`	`0`	`0`	`0.000`
`5`		[PEG]A:205	`7`	`1`	`248`	`f`	A	x,y,z	`1_555`	`20`	`9`	`8142`	`129.2`	`2.2`	`0.302`	`1`	`0`	`0`	`0.000`
`6`		[PEG]A:204	`4`	`1`	`182`	`f`	A	x,y,z	`1_555`	`18`	`11`	`8142`	`113.7`	`3.4`	`0.576`	`1`	`0`	`0`	`0.000`
`7`		[PEG]A:203	`4`	`1`	`181`	`f`	A	x,y,z	`1_555`	`17`	`8`	`8142`	`96.9`	`2.6`	`0.445`	`2`	`0`	`0`	`0.000`
`8`		[SO4]A:201	`5`	`1`	`183`	`f`	A	x,y,z	`1_555`	`16`	`7`	`8142`	`90.8`	`-14.2`	`0.738`	`1`	`0`	`0`	`0.075`
`9`		[SO4]A:202	`4`	`1`	`184`	`f`	A	x,y,z	`1_555`	`11`	`5`	`8142`	`71.4`	`-9.1`	`0.900`	`3`	`0`	`0`	`0.054`
`10`		A	`5`	`2`	`8142`	`x`	A	-x+1/2,y-1/2,-z+1	`4_546`	`8`	`2`	`8142`	`48.4`	`0.3`	`0.677`	`0`	`0`	`0`	`0.000`
`11`		[EPE]A:206	`4`	`1`	`401`	`f`	[SO4]A:201	x,y,z	`1_555`	`4`	`1`	`183`	`46.5`	`-4.1`	`0.365`	`0`	`0`	`0`	`0.021`
`12`		[EPE]A:206	`6`	`1`	`401`	`f`	[PEG]A:203	x,y,z	`1_555`	`3`	`1`	`181`	`36.0`	`2.2`	`0.104`	`0`	`0`	`0`	`0.000`
`13`		[EPE]A:206	`1`	`1`	`401`	`◊`	A	-x+1,y,-z+2	`2_657`	`1`	`1`	`8142`	`18.0`	`-0.0`	`0.161`	`0`	`0`	`0`	`0.000`
`14`		[PEG]A:203	`2`	`1`	`181`	`f`	[SO4]A:201	x,y,z	`1_555`	`1`	`1`	`183`	`11.0`	`-1.2`	`0.894`	`0`	`0`	`0`	`0.006`
`15`		[PEG]A:204	`1`	`1`	`182`	`f`	[SO4]A:201	x,y,z	`1_555`	`1`	`1`	`183`	`1.0`	`-0.1`	`1.000`	`0`	`0`	`0`	`0.000`

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

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