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Session Map (id=381-66-6E3)

Interfaces in PDB 3e0p crystal.
Space symmetry group: P 21 21 21. Resolution: 1.70 Å

THE X-RAY STRUCTURE OF HUMAN PROSTASIN IN COMPLEX WITH A COVALENT BENZOXAZOLE INHIBITOR

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`		[B3C]B:1	`50`	`1`	`1066`	`cf`	B	x,y,z	`1_555`	`85`	`29`	`11243`	`560.9`	`-7.6`	`0.543`	`10`	`0`	`0`	`0.082`
`2`		B	`69`	`20`	`11243`	`x`	B	x-1/2,-y+1/2,-z	`4_455`	`53`	`13`	`11243`	`555.1`	`-4.4`	`0.398`	`5`	`0`	`0`	`0.000`
`3`		B	`57`	`23`	`11243`	`x`	B	x-1/2,-y+3/2,-z	`4_465`	`64`	`17`	`11243`	`541.2`	`-4.3`	`0.384`	`6`	`0`	`0`	`0.000`
`4`		B	`57`	`20`	`11243`	`x`	B	-x+1/2,-y+1,z-1/2	`2_564`	`56`	`15`	`11243`	`520.9`	`-4.1`	`0.376`	`7`	`2`	`0`	`0.000`
`5`		B	`12`	`6`	`11243`	`x`	B	-x+1,y-1/2,-z+1/2	`3_645`	`14`	`4`	`11243`	`125.0`	`1.2`	`0.721`	`2`	`1`	`0`	`0.000`
`6`		B	`15`	`8`	`11243`	`f`	[GOL]B:273	x-1/2,-y+1/2,-z	`4_455`	`6`	`1`	`218`	`113.5`	`-0.4`	`0.568`	`5`	`0`	`0`	`0.018`
`7`		[B3C]B:1	`4`	`1`	`1066`	`◊`	B	x-1/2,-y+3/2,-z	`4_465`	`7`	`2`	`11243`	`57.5`	`-0.8`	`0.448`	`0`	`0`	`0`	`0.000`
`8`		[GOL]B:273	`4`	`1`	`218`	`◊`	B	x,y,z	`1_555`	`2`	`1`	`11243`	`22.3`	`0.1`	`0.714`	`1`	`0`	`0`	`0.000`
`9`		B	`1`	`1`	`11243`	`◊`	[B3C]B:1	x-1/2,-y+3/2,-z	`4_465`	`1`	`1`	`1066`	`2.0`	`-0.1`	`0.537`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe