Protein Data Bank
in Europe

Bringing Structure to Biology

PDBePISA

pdbe.org/pisa

wwPDB

EMDataBank

PISA Interface List.

Session Map (id=435-BB-JK1)

Interfaces in PDB 6p6k crystal.
Space symmetry group: P 21 21 21. Resolution: 1.55 Å

CO-CRYSTAL STRUCTURE OF HUMAN SMYD3 WITH ISOXAZOLE AMIDES INHIBITORS

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`		A	`102`	`30`	`19104`	`x`	A	-x+1,y-1/2,-z-1/2	`3_644`	`116`	`32`	`19104`	`946.4`	`-0.6`	`0.757`	`12`	`3`	`0`	`0.000`
2	`2`		[L0J]A:508	`22`	`1`	`552`	`f`	A	x,y,z	`1_555`	`61`	`23`	`19104`	`375.2`	`-8.8`	`0.453`	`3`	`0`	`0`	`0.066`
3	`3`		A	`33`	`14`	`19104`	`x`	A	x-1/2,-y-1/2,-z	`4_445`	`38`	`12`	`19104`	`285.7`	`-4.1`	`0.259`	`1`	`0`	`0`	`0.000`
4	`4`		A	`26`	`5`	`19104`	`x`	A	-x+1/2,-y,z-1/2	`2_554`	`24`	`8`	`19104`	`213.7`	`-3.3`	`0.282`	`1`	`0`	`0`	`0.000`
5	`5`		A	`20`	`7`	`19104`	`x`	A	x,y-1,z	`1_545`	`18`	`7`	`19104`	`167.8`	`-0.3`	`0.654`	`4`	`0`	`0`	`0.000`
6	`6`		A	`16`	`8`	`19104`	`x`	A	-x,y-1/2,-z-1/2	`3_544`	`19`	`6`	`19104`	`164.3`	`0.5`	`0.472`	`0`	`0`	`0`	`0.000`
7	`7`		[EDO]A:506	`4`	`1`	`183`	`f`	A	x,y,z	`1_555`	`21`	`10`	`19104`	`106.5`	`2.9`	`0.521`	`2`	`0`	`0`	`0.000`
8	`8`		A	`6`	`3`	`19104`	`x`	A	x-1/2,-y+1/2,-z	`4_455`	`10`	`3`	`19104`	`61.4`	`-1.5`	`0.222`	`0`	`0`	`0`	`0.000`
9	`9`		[MG]A:505	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`10`	`4`	`19104`	`49.1`	`-5.4`	`0.000`	`0`	`0`	`0`	`0.035`
10	`10`		[L0J]A:508	`8`	`1`	`552`	`f`	[EDO]A:506	x,y,z	`1_555`	`3`	`1`	`183`	`47.6`	`1.7`	`0.346`	`0`	`0`	`0`	`0.000`
11	`11`		A	`3`	`1`	`19104`	`x`	A	x-1,y,z	`1_455`	`6`	`2`	`19104`	`45.6`	`-0.6`	`0.249`	`0`	`0`	`0`	`0.000`
12	`12`		[MG]A:504	`1`	`1`	`98`	`f`	A	x,y,z	`1_555`	`9`	`4`	`19104`	`31.8`	`-3.6`	`0.000`	`0`	`0`	`0`	`0.023`
13	`13`		[MG]A:504	`1`	`1`	`98`	`◊`	A	x,y-1,z	`1_545`	`5`	`3`	`19104`	`23.8`	`-2.5`	`0.000`	`0`	`0`	`0`	`0.000`
	`14`		[MG]A:505	`1`	`1`	`98`	`◊`	A	x,y-1,z	`1_545`	`3`	`1`	`19104`	`12.8`	`-1.2`	`0.000`	`0`	`0`	`0`	`0.000`
	*Average:*													`18.3`	`-1.8`	`0.000`	`0`	`0`	`0`	`0.000`
14	`15`		[MG]A:505	`1`	`1`	`98`	`◊`	A	-x+1,y-1/2,-z-1/2	`3_644`	`3`	`1`	`19104`	`18.4`	`-1.8`	`0.000`	`0`	`0`	`0`	`0.000`

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