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Interfaces in PDB 3cbd crystal.
Space symmetry group: P 21 21 21. Resolution: 2.65 Å

DIRECTED EVOLUTION OF CYTOCHROME P450 BM3, TO OCTANE MONOXYGENASE 139-3

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	`110`	`26`	`20017`	`◊`	A	-x+1,y-1/2,-z+1/2	`3_645`	`106`	`25`	`20019`	`923.1`	`2.3`	`0.835`	`13`	`2`	`0`	`0.000`
2	`2`		[HEM]A:460	`43`	`1`	`847`	`f`	A	x,y,z	`1_555`	`109`	`38`	`20019`	`659.1`	`-24.4`	`0.311`	`2`	`0`	`0`	`0.098`
	`3`		[HEM]B:460	`43`	`1`	`845`	`f`	B	x,y,z	`1_555`	`98`	`36`	`20017`	`656.8`	`-22.1`	`0.457`	`2`	`0`	`0`	`0.098`
	*Average:*													`658.0`	`-23.3`	`0.384`	`2`	`0`	`0`	`0.098`
3	`4`		[140]B:500	`22`	`1`	`637`	`f`	B	x,y,z	`1_555`	`68`	`30`	`20017`	`504.7`	`1.1`	`0.186`	`3`	`0`	`0`	`0.001`
4	`5`		[140]A:500	`22`	`1`	`633`	`f`	A	x,y,z	`1_555`	`69`	`31`	`20019`	`500.3`	`-0.1`	`0.125`	`3`	`0`	`0`	`0.005`
5	`6`		B	`42`	`12`	`20017`	`◊`	A	x-1/2,-y+1/2,-z+1	`4_456`	`43`	`12`	`20019`	`414.4`	`-1.7`	`0.483`	`4`	`0`	`0`	`0.000`
6	`7`		B	`53`	`18`	`20017`	`x`	B	x-1/2,-y+1/2,-z+1	`4_456`	`51`	`15`	`20017`	`410.9`	`0.2`	`0.682`	`6`	`2`	`0`	`0.000`
7	`8`		A	`11`	`4`	`20019`	`x`	A	x-1,y,z	`1_455`	`9`	`2`	`20019`	`76.1`	`-0.2`	`0.563`	`0`	`0`	`0`	`0.000`
8	`9`		A	`9`	`3`	`20019`	`◊`	B	x-1/2,-y+1/2,-z+1	`4_456`	`8`	`3`	`20017`	`75.1`	`1.0`	`0.804`	`1`	`3`	`0`	`0.000`
9	`10`		[140]B:500	`2`	`1`	`637`	`f`	[HEM]B:460	x,y,z	`1_555`	`2`	`1`	`845`	`5.8`	`-0.2`	`0.513`	`0`	`0`	`0`	`0.000`
10	`11`		[140]A:500	`1`	`1`	`633`	`f`	[HEM]A:460	x,y,z	`1_555`	`2`	`1`	`847`	`4.8`	`-0.2`	`0.596`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe