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PISA Interface List.

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Interfaces in PDB 3pke crystal.
Space symmetry group: P 63. Resolution: 1.60 Å

M. TUBERCULOSIS METAP WITH BENGAMIDE ANALOG Y10, IN NI FORM

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	`75`	`23`	`11646`	`x`	A	-y-1,x-y,z	`2_455`	`70`	`22`	`11646`	`664.6`	`-6.3`	`0.291`	`6`	`0`	`0`	`0.152`
2	`2`		A	`44`	`12`	`11646`	`x`	A	x-y,x,z-1/2	`6_554`	`40`	`15`	`11646`	`449.1`	`-1.2`	`0.561`	`4`	`3`	`0`	`0.000`
3	`3`		[Y10]A:286	`26`	`1`	`624`	`f`	A	x,y,z	`1_555`	`57`	`22`	`11646`	`404.6`	`-2.7`	`0.381`	`13`	`0`	`0`	`0.146`
4	`4`		A	`38`	`13`	`11646`	`x`	A	-x-1,-y-1,z-1/2	`4_444`	`40`	`12`	`11646`	`359.0`	`-0.9`	`0.531`	`3`	`1`	`0`	`0.000`
5	`5`		A	`7`	`3`	`11646`	`f`	[SO4]A:290	-y-1,x-y,z	`2_455`	`4`	`1`	`186`	`60.0`	`-6.9`	`0.939`	`2`	`0`	`0`	`0.133`
6	`6`		[CL]A:289	`1`	`1`	`125`	`f`	A	x,y,z	`1_555`	`4`	`2`	`11646`	`47.0`	`-4.9`	`0.000`	`0`	`0`	`0`	`0.084`
7	`7`		A	`6`	`1`	`11646`	`x`	A	x,y,z-1	`1_554`	`4`	`1`	`11646`	`39.5`	`-0.3`	`0.466`	`0`	`0`	`0`	`0.000`
8	`8`		[SO4]A:290	`4`	`1`	`186`	`◊`	A	x,y,z	`1_555`	`5`	`2`	`11646`	`38.5`	`-4.8`	`0.826`	`1`	`0`	`0`	`0.089`
9	`9`		[NI]A:288	`1`	`1`	`115`	`f`	A	x,y,z	`1_555`	`11`	`5`	`11646`	`37.3`	`-6.4`	`0.000`	`0`	`0`	`0`	`0.109`
10	`10`		[NI]A:287	`1`	`1`	`115`	`f`	A	x,y,z	`1_555`	`11`	`6`	`11646`	`36.9`	`-7.3`	`0.000`	`0`	`0`	`0`	`0.124`
11	`11`		[NI]A:288	`1`	`1`	`115`	`f`	[Y10]A:286	x,y,z	`1_555`	`4`	`1`	`624`	`34.5`	`-3.0`	`0.000`	`0`	`0`	`0`	`0.106`
	`12`		[NI]A:287	`1`	`1`	`115`	`f`	[Y10]A:286	x,y,z	`1_555`	`5`	`1`	`624`	`34.3`	`-3.2`	`0.000`	`0`	`0`	`0`	`0.106`
	*Average:*													`34.4`	`-3.1`	`0.000`	`0`	`0`	`0`	`0.106`
12	`13`		[NI]A:288	`1`	`1`	`115`	`f`	[NI]A:287	x,y,z	`1_555`	`1`	`1`	`115`	`16.4`	`-3.3`	`0.000`	`0`	`0`	`0`	`0.056`

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