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Interfaces in PDB 3isi crystal.
Space symmetry group: P 31 2 1. Resolution: 2.20 Å

CRYSTAL STRUCTURE OF SCO3058 WITH BOUND INHIBITOR L-ALA-L-ASP PHOSPHINODIPEPTIDE

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`		X	`90`	`27`	`15239`	`◊`	X	-x,-x+y,-z+1/3	`6_555`	`90`	`27`	`15239`	`920.7`	`-3.4`	`0.482`	`10`	`8`	`0`	`0.000`
2	`2`		X	`41`	`12`	`15239`	`x`	X	-y+1,x-y+1,z+1/3	`2_665`	`45`	`11`	`15239`	`419.8`	`-0.3`	`0.612`	`3`	`2`	`0`	`0.000`
3	`3`		X	`38`	`14`	`15239`	`◊`	X	y,x,-z	`4_555`	`38`	`14`	`15239`	`345.8`	`2.2`	`0.839`	`10`	`0`	`0`	`0.000`
4	`4`		[B88]X:2000	`15`	`1`	`380`	`f`	X	x,y,z	`1_555`	`42`	`17`	`15239`	`241.9`	`0.1`	`0.476`	`8`	`0`	`0`	`0.004`
5	`5`		[ZN]X:3000	`1`	`1`	`98`	`f`	X	x,y,z	`1_555`	`11`	`7`	`15239`	`32.5`	`-23.9`	`0.000`	`0`	`0`	`0`	`0.028`
6	`6`		[ZN]X:3001	`1`	`1`	`98`	`f`	X	x,y,z	`1_555`	`12`	`8`	`15239`	`32.2`	`-23.0`	`0.000`	`0`	`0`	`0`	`0.027`
7	`7`		[ZN]X:3001	`1`	`1`	`98`	`f`	[B88]X:2000	x,y,z	`1_555`	`6`	`1`	`380`	`30.2`	`-13.2`	`0.000`	`0`	`0`	`0`	`0.028`
	`8`		[ZN]X:3000	`1`	`1`	`98`	`f`	[B88]X:2000	x,y,z	`1_555`	`4`	`1`	`380`	`26.4`	`-10.6`	`0.000`	`0`	`0`	`0`	`0.028`
	*Average:*													`28.3`	`-11.9`	`0.000`	`0`	`0`	`0`	`0.028`
8	`9`		X	`3`	`1`	`15239`	`x`	X	x-y,-y+1,-z-1/3	`5_564`	`3`	`1`	`15239`	`30.2`	`0.8`	`0.664`	`0`	`1`	`0`	`0.000`
9	`10`		[ZN]X:3001	`1`	`1`	`98`	`f`	[ZN]X:3000	x,y,z	`1_555`	`1`	`1`	`98`	`12.2`	`-9.8`	`0.000`	`0`	`0`	`0`	`0.012`

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

Protein Data Bank
in Europe