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PISA Interface List.

Session Map (id=982-HO-6CA)

Interfaces in PDB 1gj5 crystal.
Space symmetry group: C 1 2 1. Resolution: 1.73 Å

SELECTIVITY AT S1, H2O DISPLACEMENT, UPA, TPA, SER190/ALA190 PROTEASE, STRUCTURE-BASED DRUG DESIGN

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	`160`	`46`	`11931`	`◊`	L	x,y,z	`1_555`	`123`	`29`	`3532`	`1323.8`	`-14.2`	`0.232`	`19`	`8`	`1`	`0.812`
`2`		I	`58`	`10`	`1664`	`◊`	H	x,y,z	`1_555`	`69`	`18`	`11931`	`638.6`	`-5.4`	`0.309`	`4`	`2`	`0`	`0.054`
`3`		H	`35`	`9`	`11931`	`◊`	H	-x,y,-z	`2_555`	`35`	`9`	`11931`	`377.9`	`0.5`	`0.583`	`2`	`2`	`0`	`0.000`
`4`		[130]H:410	`25`	`1`	`535`	`f`	H	x,y,z	`1_555`	`59`	`23`	`11931`	`366.0`	`5.6`	`0.265`	`2`	`0`	`0`	`0.000`
`5`		H	`32`	`9`	`11931`	`x`	H	-x+1/2,y-1/2,-z+1	`4_546`	`25`	`6`	`11931`	`244.6`	`-2.2`	`0.199`	`0`	`0`	`0`	`0.000`
`6`		L	`28`	`5`	`3532`	`◊`	L	-x,y,-z+1	`2_556`	`28`	`5`	`3532`	`219.0`	`0.9`	`0.878`	`0`	`0`	`0`	`0.000`
`7`		L	`21`	`5`	`3532`	`◊`	H	x-1/2,y+1/2,z	`3_455`	`22`	`6`	`11931`	`200.2`	`0.0`	`0.686`	`0`	`2`	`0`	`0.000`
`8`		H	`13`	`5`	`11931`	`◊`	H	-x+1,y,-z+1	`2_656`	`13`	`5`	`11931`	`139.5`	`3.7`	`0.924`	`1`	`8`	`0`	`0.000`
`9`		H	`9`	`1`	`11931`	`◊`	L	-x+1/2,y-1/2,-z+1	`4_546`	`12`	`6`	`3532`	`95.2`	`0.9`	`0.751`	`1`	`0`	`0`	`0.000`
`10`		[NA]H:409	`1`	`1`	`125`	`f`	H	x,y,z	`1_555`	`19`	`12`	`11931`	`79.4`	`-11.2`	`0.000`	`0`	`0`	`0`	`0.326`
`11`		I	`7`	`2`	`1664`	`◊`	H	-x,y,-z	`2_555`	`9`	`4`	`11931`	`47.9`	`-0.0`	`0.526`	`0`	`0`	`0`	`0.000`
`12`		H	`3`	`1`	`11931`	`x`	H	x-1/2,y-1/2,z	`3_445`	`4`	`2`	`11931`	`33.4`	`1.2`	`0.762`	`0`	`0`	`0`	`0.000`
`13`		H	`1`	`1`	`11931`	`◊`	H	-x,y,-z+1	`2_556`	`1`	`1`	`11931`	`0.4`	`-0.0`	`0.579`	`0`	`0`	`0`	`0.000`

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