PDBe < PISA < EMBL-EBI

PISA Interface List.

Session Map (id=535-H3-030)

Interfaces in PDB 1v40 crystal.
Space symmetry group: P 1. Resolution: 1.90 Å

FIRST INHIBITOR COMPLEX STRUCTURE OF HUMAN HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE

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`		C	`125`	`33`	`10791`	`◊`	B	x,y,z	`1_555`	`131`	`32`	`10687`	`1297.0`	`-20.2`	`0.065`	`12`	`2`	`0`	`0.506`
	`2`		D	`127`	`32`	`10807`	`◊`	A	x,y,z	`1_555`	`133`	`33`	`10701`	`1290.9`	`-20.1`	`0.075`	`11`	`3`	`0`	`0.506`
	*Average:*													`1293.9`	`-20.1`	`0.070`	`12`	`3`	`0`	`0.506`
2	`3`		[O16]A:3201	`31`	`1`	`683`	`cf`	A	x,y,z	`1_555`	`60`	`19`	`10701`	`415.8`	`-1.0`	`0.368`	`0`	`0`	`0`	`0.045`
	`4`		[O16]B:3401	`32`	`1`	`682`	`f`	B	x,y,z	`1_555`	`55`	`18`	`10687`	`408.3`	`-2.3`	`0.253`	`0`	`0`	`0`	`0.045`
	*Average:*													`412.0`	`-1.7`	`0.311`	`0`	`0`	`0`	`0.045`
3	`5`		[O16]D:3801	`34`	`1`	`671`	`f`	D	x,y,z	`1_555`	`54`	`17`	`10807`	`405.7`	`-2.5`	`0.220`	`0`	`0`	`0`	`0.049`
	`6`		[O16]C:3601	`32`	`1`	`688`	`cf`	C	x,y,z	`1_555`	`56`	`18`	`10791`	`404.3`	`-2.2`	`0.269`	`0`	`0`	`0`	`0.049`
	*Average:*													`405.0`	`-2.3`	`0.245`	`0`	`0`	`0`	`0.049`
4	`7`		[GSH]A:3200	`19`	`1`	`515`	`f`	A	x,y,z	`1_555`	`41`	`14`	`10701`	`303.1`	`-2.8`	`0.743`	`8`	`0`	`0`	`0.280`
	`8`		[GSH]B:3400	`19`	`1`	`514`	`f`	B	x,y,z	`1_555`	`41`	`15`	`10687`	`299.0`	`-3.5`	`0.714`	`8`	`0`	`0`	`0.280`
	`9`		[GSH]D:3800	`19`	`1`	`514`	`f`	D	x,y,z	`1_555`	`39`	`12`	`10807`	`296.8`	`-4.1`	`0.682`	`8`	`0`	`0`	`0.280`
	`10`		[GSH]C:3600	`19`	`1`	`514`	`f`	C	x,y,z	`1_555`	`40`	`14`	`10791`	`292.1`	`-4.3`	`0.646`	`7`	`0`	`0`	`0.280`
	*Average:*													`297.8`	`-3.7`	`0.696`	`8`	`0`	`0`	`0.280`
5	`11`		C	`30`	`10`	`10791`	`◊`	D	x-1,y,z	`1_455`	`33`	`10`	`10807`	`261.7`	`2.2`	`0.887`	`4`	`3`	`0`	`0.000`
	`12`		D	`27`	`9`	`10807`	`◊`	C	x,y,z	`1_555`	`30`	`10`	`10791`	`256.9`	`2.4`	`0.896`	`4`	`3`	`0`	`0.000`
	*Average:*													`259.3`	`2.3`	`0.891`	`4`	`3`	`0`	`0.000`
6	`13`		D	`21`	`7`	`10807`	`x`	D	x-1,y,z	`1_455`	`32`	`11`	`10807`	`229.0`	`-1.0`	`0.406`	`1`	`2`	`0`	`0.000`
	`14`		C	`22`	`7`	`10791`	`x`	C	x-1,y,z	`1_455`	`29`	`10`	`10791`	`228.0`	`-1.1`	`0.401`	`1`	`2`	`0`	`0.000`
	*Average:*													`228.5`	`-1.1`	`0.404`	`1`	`2`	`0`	`0.000`
7	`15`		B	`15`	`5`	`10687`	`◊`	C	x-1,y,z	`1_455`	`14`	`4`	`10791`	`168.6`	`-3.9`	`0.111`	`1`	`0`	`0`	`0.000`
	`16`		A	`14`	`5`	`10701`	`◊`	D	x-1,y,z	`1_455`	`15`	`4`	`10807`	`167.5`	`-4.0`	`0.104`	`1`	`0`	`0`	`0.000`
	*Average:*													`168.0`	`-3.9`	`0.108`	`1`	`0`	`0`	`0.000`
8	`17`		C	`10`	`4`	`10791`	`x`	C	x,y-1,z	`1_545`	`18`	`4`	`10791`	`148.6`	`-2.6`	`0.240`	`1`	`0`	`0`	`0.000`
	`18`		D	`18`	`5`	`10807`	`x`	D	x,y-1,z	`1_545`	`10`	`4`	`10807`	`146.8`	`-2.4`	`0.270`	`1`	`0`	`0`	`0.000`
	*Average:*													`147.7`	`-2.5`	`0.255`	`1`	`0`	`0`	`0.000`
9	`19`		B	`16`	`6`	`10687`	`◊`	A	x-1,y,z-1	`1_454`	`14`	`4`	`10701`	`147.6`	`0.7`	`0.769`	`1`	`0`	`0`	`0.000`
	`20`		B	`12`	`4`	`10687`	`◊`	A	x,y,z-1	`1_554`	`16`	`6`	`10701`	`110.9`	`0.6`	`0.769`	`0`	`1`	`0`	`0.000`
	*Average:*													`129.2`	`0.7`	`0.769`	`1`	`1`	`0`	`0.000`
10	`21`		[GOL]B:3006	`6`	`1`	`220`	`f`	B	x,y,z	`1_555`	`19`	`6`	`10687`	`115.1`	`-0.3`	`0.606`	`4`	`0`	`0`	`0.040`
11	`22`		[GOL]A:3002	`6`	`1`	`219`	`f`	A	x,y,z	`1_555`	`19`	`7`	`10701`	`113.5`	`-0.7`	`0.504`	`4`	`0`	`0`	`0.050`
12	`23`		[GOL]D:3005	`6`	`1`	`217`	`f`	D	x,y,z	`1_555`	`15`	`5`	`10807`	`110.4`	`-0.2`	`0.579`	`4`	`0`	`0`	`0.040`
13	`24`		A	`13`	`6`	`10701`	`◊`	D	x,y-1,z	`1_545`	`8`	`5`	`10807`	`104.1`	`-0.9`	`0.491`	`0`	`0`	`0`	`0.000`
	`25`		C	`9`	`4`	`10791`	`◊`	B	x,y-1,z	`1_545`	`11`	`5`	`10687`	`100.6`	`-0.5`	`0.528`	`1`	`1`	`0`	`0.000`
	*Average:*													`102.3`	`-0.7`	`0.510`	`1`	`1`	`0`	`0.000`
14	`26`		[GOL]C:3003	`6`	`1`	`223`	`◊`	D	x-1,y,z	`1_455`	`18`	`6`	`10807`	`104.1`	`0.7`	`0.733`	`2`	`0`	`0`	`0.000`
15	`27`		B	`13`	`4`	`10687`	`x`	B	x-1,y,z	`1_455`	`10`	`3`	`10687`	`99.3`	`-0.8`	`0.467`	`0`	`0`	`0`	`0.000`
	`28`		A	`12`	`4`	`10701`	`x`	A	x-1,y,z	`1_455`	`10`	`3`	`10701`	`97.3`	`-0.7`	`0.477`	`0`	`0`	`0`	`0.000`
	*Average:*													`98.3`	`-0.8`	`0.472`	`0`	`0`	`0`	`0.000`
16	`29`		[GOL]C:3004	`6`	`1`	`221`	`f`	C	x,y,z	`1_555`	`19`	`6`	`10791`	`99.1`	`1.0`	`0.767`	`5`	`0`	`0`	`0.024`
17	`30`		[O16]A:3201	`15`	`1`	`683`	`f`	[GSH]A:3200	x,y,z	`1_555`	`8`	`1`	`515`	`88.6`	`-0.6`	`0.499`	`1`	`0`	`0`	`0.023`
	`31`		[O16]B:3401	`15`	`1`	`682`	`f`	[GSH]B:3400	x,y,z	`1_555`	`8`	`1`	`514`	`86.5`	`-0.8`	`0.491`	`1`	`0`	`0`	`0.023`
	*Average:*													`87.5`	`-0.7`	`0.495`	`1`	`0`	`0`	`0.023`
18	`32`		B	`8`	`3`	`10687`	`◊`	A	x-1,y+1,z-1	`1_464`	`10`	`4`	`10701`	`84.2`	`1.7`	`0.670`	`3`	`3`	`0`	`0.000`
	`33`		A	`8`	`3`	`10701`	`◊`	B	x,y-1,z+1	`1_546`	`9`	`4`	`10687`	`84.1`	`1.6`	`0.787`	`1`	`3`	`0`	`0.000`
	*Average:*													`84.1`	`1.6`	`0.729`	`2`	`3`	`0`	`0.000`
19	`34`		A	`10`	`3`	`10701`	`x`	A	x,y-1,z	`1_545`	`10`	`2`	`10701`	`79.7`	`-0.4`	`0.444`	`0`	`0`	`0`	`0.000`
	`35`		B	`13`	`2`	`10687`	`x`	B	x,y-1,z	`1_545`	`6`	`2`	`10687`	`73.5`	`0.5`	`0.741`	`1`	`0`	`0`	`0.000`
	*Average:*													`76.6`	`0.1`	`0.593`	`1`	`0`	`0`	`0.000`
20	`36`		[GOL]C:3003	`4`	`1`	`223`	`f`	C	x,y,z	`1_555`	`14`	`3`	`10791`	`77.1`	`-0.8`	`0.437`	`1`	`0`	`0`	`0.024`
21	`37`		[GOL]A:3001	`6`	`1`	`217`	`◊`	A	x,y,z	`1_555`	`14`	`4`	`10701`	`76.2`	`-0.4`	`0.532`	`0`	`0`	`0`	`0.007`
22	`38`		[O16]C:3601	`13`	`1`	`688`	`f`	[GSH]C:3600	x,y,z	`1_555`	`7`	`1`	`514`	`74.6`	`-0.3`	`0.523`	`1`	`0`	`0`	`0.014`
	`39`		[O16]D:3801	`15`	`1`	`671`	`f`	[GSH]D:3800	x,y,z	`1_555`	`7`	`1`	`514`	`63.3`	`-0.3`	`0.481`	`0`	`0`	`0`	`0.014`
	*Average:*													`68.9`	`-0.3`	`0.502`	`1`	`0`	`0`	`0.014`
23	`40`		[GOL]A:3001	`4`	`1`	`217`	`f`	D	x,y,z	`1_555`	`13`	`4`	`10807`	`72.7`	`-0.3`	`0.543`	`1`	`0`	`0`	`0.015`
24	`41`		[GOL]C:3004	`5`	`1`	`221`	`◊`	D	x,y,z	`1_555`	`13`	`3`	`10807`	`71.6`	`-0.4`	`0.524`	`1`	`0`	`0`	`0.000`
25	`42`		[GOL]A:3002	`4`	`1`	`219`	`◊`	D	x-1,y,z	`1_455`	`8`	`1`	`10807`	`42.8`	`-0.7`	`0.434`	`0`	`0`	`0`	`0.000`
26	`43`		[MG]A:3900	`1`	`1`	`98`	`◊`	A	x,y,z	`1_555`	`8`	`4`	`10701`	`41.5`	`-4.4`	`0.000`	`0`	`0`	`0`	`0.149`
	`44`		[MG]B:3901	`1`	`1`	`98`	`◊`	B	x,y,z	`1_555`	`8`	`4`	`10687`	`41.4`	`-4.5`	`0.000`	`0`	`0`	`0`	`0.149`
	`45`		[MG]A:3900	`1`	`1`	`98`	`◊`	D	x,y,z	`1_555`	`8`	`4`	`10807`	`41.1`	`-4.4`	`0.000`	`0`	`0`	`0`	`0.149`
	`46`		[MG]B:3901	`1`	`1`	`98`	`◊`	C	x,y,z	`1_555`	`8`	`4`	`10791`	`40.6`	`-4.3`	`0.000`	`0`	`0`	`0`	`0.149`
	*Average:*													`41.1`	`-4.4`	`0.000`	`0`	`0`	`0`	`0.149`
27	`47`		[GOL]D:3005	`5`	`1`	`217`	`◊`	C	x,y,z	`1_555`	`4`	`1`	`10791`	`38.2`	`0.6`	`0.630`	`0`	`0`	`0`	`0.000`
28	`48`		[GSH]B:3400	`3`	`1`	`514`	`◊`	C	x,y,z	`1_555`	`4`	`2`	`10791`	`37.2`	`0.2`	`0.715`	`1`	`0`	`0`	`0.009`
	`49`		[GSH]A:3200	`4`	`1`	`515`	`◊`	D	x,y,z	`1_555`	`4`	`2`	`10807`	`36.5`	`0.2`	`0.735`	`1`	`0`	`0`	`0.009`
	`50`		[GSH]C:3600	`3`	`1`	`514`	`◊`	B	x,y,z	`1_555`	`4`	`2`	`10687`	`35.5`	`0.3`	`0.723`	`1`	`0`	`0`	`0.009`
	`51`		[GSH]D:3800	`3`	`1`	`514`	`◊`	A	x,y,z	`1_555`	`4`	`2`	`10701`	`35.0`	`0.3`	`0.730`	`1`	`0`	`0`	`0.009`
	*Average:*													`36.0`	`0.2`	`0.726`	`1`	`0`	`0`	`0.009`
29	`52`		[GOL]D:3005	`4`	`1`	`217`	`◊`	[GOL]C:3004	x,y,z	`1_555`	`2`	`1`	`221`	`29.6`	`0.2`	`0.614`	`1`	`0`	`0`	`0.000`
30	`53`		C	`1`	`1`	`10791`	`◊`	D	x-1,y+1,z	`1_465`	`1`	`1`	`10807`	`3.9`	`-0.1`	`0.365`	`0`	`0`	`0`	`0.000`

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

Protein Data Bank
in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank in Europe

Bringing Structure to Biology

PDBePISA

Protein Data Bank
in Europe