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Interfaces in PDB 1cku crystal.
Space symmetry group: P 21 21 21. Resolution: 1.20 Å

AB INITIO SOLUTION AND REFINEMENT OF TWO HIGH POTENTIAL IRON PROTEIN STRUCTURES AT ATOMIC RESOLUTION

Interfaces

##			Structure 1				×	Structure 2						interface area, Å²	ΔⁱG kcal/mol	ΔⁱG P-value	N_HB	N_SB	N_DS	CSS
Id	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	`1`		B	`43`	`13`	`4951`	`◊`	A	x,y,z	`1_555`	`47`	`17`	`4922`	`468.3`	`-4.6`	`0.448`	`2`	`0`	`0`	`0.000`
2	`2`		A	`45`	`14`	`4922`	`◊`	B	x-1,y,z	`1_455`	`38`	`13`	`4951`	`437.6`	`-1.5`	`0.630`	`7`	`2`	`0`	`0.000`
3	`3`		B	`37`	`12`	`4951`	`◊`	A	-x+1,y-1/2,-z+1/2	`3_645`	`32`	`9`	`4922`	`319.6`	`-2.2`	`0.544`	`2`	`0`	`0`	`0.000`
4	`4`		B	`31`	`12`	`4951`	`x`	B	-x+1,y-1/2,-z+1/2	`3_645`	`28`	`9`	`4951`	`288.5`	`-4.1`	`0.356`	`0`	`0`	`0`	`0.000`
5	`5`		B	`30`	`10`	`4951`	`◊`	A	-x,y-1/2,-z+1/2	`3_545`	`22`	`8`	`4922`	`216.4`	`-2.9`	`0.437`	`2`	`0`	`0`	`0.000`
6	`6`		A	`23`	`8`	`4922`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`21`	`7`	`4951`	`210.2`	`-2.5`	`0.377`	`0`	`0`	`0`	`0.000`
7	`7`		A	`26`	`9`	`4922`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`23`	`11`	`4922`	`192.2`	`-0.8`	`0.651`	`1`	`0`	`0`	`0.000`
8	`8`		[SF4]A:87	`8`	`1`	`309`	`f`	A	x,y,z	`1_555`	`26`	`13`	`4922`	`185.8`	`-21.7`	`0.428`	`0`	`0`	`0`	`0.100`
	`9`		[SF4]B:87	`8`	`1`	`309`	`f`	B	x,y,z	`1_555`	`25`	`12`	`4951`	`185.7`	`-21.6`	`0.434`	`0`	`0`	`0`	`0.100`
	*Average:*													`185.8`	`-21.6`	`0.431`	`0`	`0`	`0`	`0.100`

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

Protein Data Bank
in Europe