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Interfaces in PDB 2ohm crystal.
Space symmetry group: P 61 2 2. Resolution: 2.70 Å

X-RAY CRYSTAL STRUCTURE OF BETA SECRETASE COMPLEXED WITH N~3~-BENZYLPYRIDINE-2,3-DIAMINE

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	`186`	`55`	`16470`	`◊`	A	x,x-y,-z+1/6	`12_555`	`187`	`55`	`16470`	`1683.6`	`-0.9`	`0.730`	`22`	`2`	`0`	`0.000`
`2`		A	`57`	`15`	`16470`	`x`	A	x-y+1,x,z+1/6	`6_655`	`55`	`17`	`16470`	`520.1`	`-1.5`	`0.514`	`3`	`2`	`0`	`0.000`
`3`		A	`39`	`12`	`16470`	`◊`	A	-y+1,-x+1,-z-1/6	`10_664`	`39`	`12`	`16470`	`266.4`	`-3.2`	`0.314`	`0`	`0`	`0`	`0.000`
`4`		A	`19`	`7`	`16470`	`x`	A	x-y,-y+1,-z	`8_565`	`32`	`8`	`16470`	`234.6`	`-1.5`	`0.338`	`3`	`2`	`0`	`0.000`
`5`		[8AP]A:389	`15`	`1`	`377`	`f`	A	x,y,z	`1_555`	`36`	`14`	`16470`	`223.5`	`0.1`	`0.337`	`4`	`0`	`0`	`0.600`
`6`		[DMS]A:388	`4`	`1`	`215`	`f`	A	x,y,z	`1_555`	`19`	`7`	`16470`	`104.7`	`2.0`	`0.390`	`0`	`0`	`0`	`0.000`
`7`		[IOD]A:386	`1`	`1`	`144`	`◊`	A	x,y,z	`1_555`	`18`	`10`	`16470`	`79.8`	`0.1`	`0.773`	`0`	`0`	`0`	`0.000`
`8`		[IOD]A:387	`1`	`1`	`144`	`◊`	A	x,y,z	`1_555`	`16`	`7`	`16470`	`79.8`	`-0.0`	`0.723`	`0`	`0`	`0`	`0.000`
`9`		[IOD]A:387	`1`	`1`	`144`	`f`	A	x,x-y,-z+1/6	`12_555`	`6`	`3`	`16470`	`35.9`	`-0.2`	`0.624`	`0`	`0`	`0`	`0.077`
`10`		[IOD]A:386	`1`	`1`	`144`	`f`	A	x-y+1,x,z+1/6	`6_655`	`2`	`1`	`16470`	`29.4`	`-0.4`	`0.290`	`0`	`0`	`0`	`0.142`
`11`		[IOD]A:387	`1`	`1`	`144`	`◊`	[IOD]A:387	x,x-y,-z+1/6	`12_555`	`1`	`1`	`144`	`8.2`	`0.0`	`1.000`	`0`	`0`	`0`	`0.000`
`12`		[8AP]A:389	`1`	`1`	`377`	`◊`	A	x,x-y,-z+1/6	`12_555`	`1`	`1`	`16470`	`1.6`	`0.0`	`0.560`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
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