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PISA Interface List.

Session Map (id=272-F4-EF7)

Interfaces in PDB 4key crystal.
Space symmetry group: P 21 21 21. Resolution: 2.05 Å

STRUCTURE OF P450 BM3 A82F F87V IN COMPLEX WITH OMEPRAZOLE

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	`100`	`22`	`19276`	`◊`	A	-x+1/2,-y,z-1/2	`2_554`	`99`	`25`	`19349`	`813.9`	`0.8`	`0.794`	`6`	`0`	`0`	`0.000`
2	`2`		B	`80`	`24`	`19276`	`◊`	A	x,y,z	`1_555`	`85`	`28`	`19349`	`669.2`	`-3.0`	`0.510`	`1`	`1`	`0`	`0.000`
3	`3`		[HEM]B:501	`43`	`1`	`853`	`f`	B	x,y,z	`1_555`	`95`	`35`	`19276`	`622.7`	`-20.5`	`0.532`	`3`	`0`	`0`	`0.095`
	`4`		[HEM]A:501	`43`	`1`	`846`	`f`	A	x,y,z	`1_555`	`92`	`36`	`19349`	`621.5`	`-20.5`	`0.531`	`4`	`0`	`0`	`0.095`
	*Average:*													`622.1`	`-20.5`	`0.532`	`4`	`0`	`0`	`0.095`
4	`5`		[1C6]B:502	`23`	`1`	`568`	`f`	B	x,y,z	`1_555`	`57`	`27`	`19276`	`420.6`	`-0.6`	`0.129`	`1`	`0`	`0`	`0.005`
5	`6`		[1C6]A:502	`23`	`1`	`561`	`f`	A	x,y,z	`1_555`	`56`	`27`	`19349`	`406.5`	`-0.8`	`0.140`	`0`	`0`	`0`	`0.003`
6	`7`		A	`37`	`12`	`19349`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`44`	`17`	`19349`	`311.0`	`2.1`	`0.852`	`3`	`0`	`0`	`0.000`
7	`8`		B	`13`	`5`	`19276`	`x`	B	x-1/2,-y-1/2,-z	`4_445`	`11`	`5`	`19276`	`117.3`	`1.7`	`0.830`	`1`	`2`	`0`	`0.000`
8	`9`		A	`10`	`4`	`19349`	`x`	A	x-1,y,z	`1_455`	`15`	`6`	`19349`	`117.3`	`-1.1`	`0.270`	`2`	`0`	`0`	`0.000`
	`10`		B	`8`	`3`	`19276`	`x`	B	x-1,y,z	`1_455`	`14`	`6`	`19276`	`113.6`	`-1.1`	`0.221`	`1`	`0`	`0`	`0.000`
	*Average:*													`115.4`	`-1.1`	`0.246`	`2`	`0`	`0`	`0.000`
9	`11`		A	`10`	`5`	`19349`	`◊`	B	x-1,y,z	`1_455`	`9`	`3`	`19276`	`74.8`	`-0.2`	`0.583`	`0`	`0`	`0`	`0.000`
10	`12`		[1C6]B:502	`6`	`1`	`568`	`f`	[HEM]B:501	x,y,z	`1_555`	`23`	`1`	`853`	`70.6`	`-0.6`	`0.707`	`0`	`0`	`0`	`0.003`
11	`13`		[1C6]A:502	`4`	`1`	`561`	`f`	[HEM]A:501	x,y,z	`1_555`	`22`	`1`	`846`	`68.1`	`-0.4`	`0.754`	`0`	`0`	`0`	`0.002`

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