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PISA Interface List.

Session Map (id=883-5H-57P)

Interfaces in PDB 3nca crystal.
Space symmetry group: P 21 21 21. Resolution: 2.60 Å

X-RAY STRUCTURE OF KETOHEXOKINASE IN COMPLEX WITH A THIENO PYRIDINOL COMPOUND

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	`146`	`39`	`14744`	`◊`	A	x,y,z	`1_555`	`154`	`41`	`13696`	`1550.1`	`-11.9`	`0.186`	`26`	`4`	`0`	`0.260`
`2`		A	`76`	`21`	`13696`	`◊`	B	-x,y-1/2,-z+1/2	`3_545`	`81`	`26`	`14744`	`665.6`	`-5.3`	`0.248`	`6`	`0`	`0`	`0.000`
`3`		B	`74`	`20`	`14744`	`x`	B	x-1/2,-y+1/2,-z+1	`4_456`	`72`	`17`	`14744`	`624.3`	`-0.0`	`0.679`	`7`	`7`	`0`	`0.000`
`4`		[TR2]A:300	`10`	`1`	`286`	`f`	A	x,y,z	`1_555`	`39`	`18`	`13696`	`217.5`	`-6.5`	`0.256`	`0`	`0`	`0`	`0.070`
`5`		[SO4]A:299	`5`	`1`	`186`	`f`	A	x,y,z	`1_555`	`21`	`10`	`13696`	`117.5`	`-17.4`	`0.720`	`9`	`0`	`0`	`0.232`
`6`		[SO4]B:299	`5`	`1`	`185`	`f`	B	x,y,z	`1_555`	`19`	`9`	`14744`	`115.4`	`-16.0`	`0.806`	`4`	`0`	`0`	`0.192`
`7`		A	`17`	`6`	`13696`	`◊`	B	-x-1/2,-y,z-1/2	`2_454`	`14`	`7`	`14744`	`115.0`	`1.5`	`0.767`	`1`	`0`	`0`	`0.000`
`8`		[SO4]B:300	`5`	`1`	`184`	`f`	B	x,y,z	`1_555`	`12`	`6`	`14744`	`111.4`	`-15.1`	`0.893`	`5`	`0`	`0`	`0.187`
`9`		A	`8`	`2`	`13696`	`x`	A	-x,y-1/2,-z+1/2	`3_545`	`9`	`4`	`13696`	`73.1`	`0.9`	`0.552`	`0`	`0`	`0`	`0.000`
`10`		[SO4]B:300	`4`	`1`	`184`	`◊`	A	x,y,z	`1_555`	`2`	`1`	`13696`	`35.7`	`-2.9`	`0.980`	`1`	`0`	`0`	`0.036`
`11`		[SO4]A:299	`2`	`1`	`186`	`◊`	B	x,y,z	`1_555`	`1`	`1`	`14744`	`10.0`	`-1.1`	`0.889`	`0`	`0`	`0`	`0.011`
`12`		[TR2]A:300	`2`	`1`	`286`	`f`	[SO4]A:299	x,y,z	`1_555`	`1`	`1`	`186`	`7.4`	`-0.9`	`0.834`	`0`	`0`	`0`	`0.010`

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