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Interfaces in PDB 1o2g crystal.
Space symmetry group: C 1 2 1. Resolution: 1.58 Å

ELABORATE MANIFOLD OF SHORT HYDROGEN BOND ARRAYS MEDIATING BINDING OF ACTIVE SITE-DIRECTED SERINE PROTEASE INHIBITORS

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`		H	`165`	`47`	`11961`	`◊`	L	x,y,z	`1_555`	`124`	`26`	`3628`	`1371.4`	`-13.1`	`0.280`	`19`	`9`	`1`	`0.779`
`2`		I	`56`	`9`	`1591`	`◊`	H	x,y,z	`1_555`	`66`	`17`	`11961`	`625.9`	`-3.7`	`0.405`	`4`	`2`	`0`	`0.000`
`3`		H	`35`	`9`	`11961`	`◊`	H	-x,y,-z	`2_555`	`36`	`9`	`11961`	`384.8`	`0.5`	`0.571`	`2`	`2`	`0`	`0.000`
`4`		[696]H:410	`25`	`1`	`542`	`f`	H	x,y,z	`1_555`	`58`	`23`	`11961`	`367.0`	`5.1`	`0.261`	`3`	`0`	`0`	`0.000`
`5`		L	`32`	`7`	`3628`	`◊`	L	-x,y,-z+1	`2_556`	`32`	`7`	`3628`	`261.4`	`0.6`	`0.880`	`0`	`4`	`0`	`0.000`
`6`		H	`33`	`9`	`11961`	`x`	H	-x+1/2,y-1/2,-z+1	`4_546`	`31`	`8`	`11961`	`251.4`	`-2.2`	`0.237`	`0`	`0`	`0`	`0.000`
`7`		L	`21`	`5`	`3628`	`◊`	H	x-1/2,y+1/2,z	`3_455`	`21`	`6`	`11961`	`201.8`	`0.3`	`0.718`	`1`	`2`	`0`	`0.000`
`8`		H	`16`	`6`	`11961`	`◊`	H	-x+1,y,-z+1	`2_656`	`16`	`6`	`11961`	`145.0`	`3.7`	`0.909`	`2`	`10`	`0`	`0.000`
`9`		H	`11`	`4`	`11961`	`◊`	L	-x+1/2,y-1/2,-z+1	`4_546`	`23`	`6`	`3628`	`127.1`	`0.9`	`0.812`	`2`	`0`	`0`	`0.000`
`10`		[NA]H:409	`1`	`1`	`125`	`f`	H	x,y,z	`1_555`	`18`	`11`	`11961`	`80.9`	`-11.4`	`0.000`	`0`	`0`	`0`	`0.329`
`11`		I	`7`	`2`	`1591`	`◊`	H	-x,y,-z	`2_555`	`8`	`3`	`11961`	`50.9`	`0.0`	`0.524`	`0`	`0`	`0`	`0.000`
`12`		H	`3`	`1`	`11961`	`x`	H	x-1/2,y-1/2,z	`3_445`	`4`	`2`	`11961`	`33.0`	`1.1`	`0.734`	`0`	`0`	`0`	`0.000`
`13`		H	`1`	`1`	`11961`	`◊`	H	-x,y,-z+1	`2_556`	`1`	`1`	`11961`	`0.8`	`-0.0`	`0.542`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe