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PISA Interface List.

Session Map (id=869-F5-CPO)

Interfaces in PDB 6q13 crystal.
Space symmetry group: P 21 21 2. Resolution: 2.00 Å

CRYSTAL STRUCTURE OF LDHA IN COMPLEX WITH COMPOUND NCGC00420737-09 AT 2.00 A RESOLUTION

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`		D	`290`	`67`	`16653`	`◊`	B	-x-1/2,y-1/2,-z	`3_445`	`287`	`67`	`16166`	`2784.6`	`-48.6`	`0.008`	`19`	`8`	`0`	`0.564`
	`2`		C	`293`	`68`	`16554`	`◊`	A	x,y,z	`1_555`	`290`	`68`	`16459`	`2770.9`	`-46.7`	`0.010`	`17`	`8`	`0`	`0.564`
	*Average:*													`2777.7`	`-47.6`	`0.009`	`18`	`8`	`0`	`0.564`
2	`3`		D	`155`	`38`	`16653`	`◊`	D	-x-1,-y,z	`2_455`	`155`	`38`	`16653`	`1518.1`	`-5.7`	`0.765`	`26`	`2`	`0`	`0.368`
	`4`		B	`155`	`41`	`16166`	`◊`	B	-x,-y+1,z	`2_565`	`157`	`41`	`16166`	`1511.2`	`-9.1`	`0.689`	`24`	`6`	`0`	`0.368`
	`5`		A	`153`	`40`	`16459`	`◊`	A	-x,-y+1,z	`2_565`	`153`	`40`	`16459`	`1490.9`	`-12.1`	`0.466`	`22`	`2`	`0`	`0.368`
	`6`		C	`149`	`40`	`16554`	`◊`	C	-x,-y+1,z	`2_565`	`150`	`40`	`16554`	`1487.5`	`-9.5`	`0.544`	`26`	`2`	`0`	`0.368`
	*Average:*													`1501.9`	`-9.1`	`0.616`	`25`	`3`	`0`	`0.368`
3	`7`		C	`95`	`27`	`16554`	`◊`	A	-x,-y+1,z	`2_565`	`94`	`27`	`16459`	`887.8`	`-12.5`	`0.169`	`8`	`0`	`0`	`0.268`
	`8`		D	`92`	`27`	`16653`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`93`	`26`	`16166`	`879.6`	`-12.3`	`0.188`	`8`	`0`	`0`	`0.268`
	*Average:*													`883.7`	`-12.4`	`0.179`	`8`	`0`	`0`	`0.268`
4	`9`		D	`69`	`21`	`16653`	`◊`	A	x,y,z	`1_555`	`69`	`22`	`16459`	`637.5`	`-2.4`	`0.695`	`10`	`10`	`0`	`0.015`
5	`10`		[NAI]A:401	`41`	`1`	`875`	`f`	A	x,y,z	`1_555`	`86`	`34`	`16459`	`611.6`	`-6.1`	`0.610`	`9`	`0`	`0`	`0.367`
	`11`		[NAI]C:401	`41`	`1`	`876`	`f`	C	x,y,z	`1_555`	`86`	`34`	`16554`	`608.6`	`-6.6`	`0.562`	`9`	`0`	`0`	`0.367`
	`12`		[NAI]B:401	`42`	`1`	`879`	`f`	B	x,y,z	`1_555`	`85`	`34`	`16166`	`608.3`	`-6.3`	`0.627`	`10`	`0`	`0`	`0.367`
	`13`		[NAI]D:401	`40`	`1`	`875`	`f`	D	x,y,z	`1_555`	`85`	`34`	`16653`	`593.3`	`-5.2`	`0.628`	`9`	`0`	`0`	`0.367`
	*Average:*													`605.5`	`-6.1`	`0.607`	`9`	`0`	`0`	`0.367`
6	`14`		[P8V]C:402	`43`	`1`	`841`	`f`	C	x,y,z	`1_555`	`69`	`24`	`16554`	`567.5`	`-8.6`	`0.609`	`12`	`0`	`0`	`0.481`
	`15`		[P8V]A:402	`43`	`1`	`836`	`f`	A	x,y,z	`1_555`	`73`	`24`	`16459`	`533.4`	`-8.3`	`0.601`	`12`	`0`	`0`	`0.481`
	`16`		[P8V]B:402	`42`	`1`	`845`	`f`	B	x,y,z	`1_555`	`65`	`25`	`16166`	`529.6`	`-9.0`	`0.562`	`11`	`0`	`0`	`0.481`
	`17`		[P8V]D:402	`43`	`1`	`833`	`f`	D	x,y,z	`1_555`	`73`	`26`	`16653`	`523.2`	`-8.1`	`0.614`	`12`	`0`	`0`	`0.481`
	*Average:*													`538.4`	`-8.5`	`0.596`	`12`	`0`	`0`	`0.481`
7	`18`		B	`41`	`14`	`16166`	`◊`	A	x,y,z	`1_555`	`43`	`14`	`16459`	`385.9`	`-2.8`	`0.569`	`4`	`0`	`0`	`0.000`
8	`19`		D	`40`	`9`	`16653`	`◊`	C	-x-1/2,y-1/2,-z-1	`3_444`	`40`	`9`	`16554`	`352.3`	`-5.7`	`0.254`	`2`	`0`	`0`	`0.000`
9	`20`		[EDO]C:405	`4`	`1`	`186`	`f`	C	x,y,z	`1_555`	`13`	`6`	`16554`	`111.6`	`2.9`	`0.415`	`3`	`0`	`0`	`0.000`
10	`21`		[EDO]C:404	`4`	`1`	`187`	`f`	C	x,y,z	`1_555`	`15`	`6`	`16554`	`105.1`	`3.0`	`0.464`	`3`	`0`	`0`	`0.000`
11	`22`		D	`13`	`7`	`16653`	`◊`	C	x-1/2,-y+1/2,-z-1	`4_454`	`13`	`6`	`16554`	`99.2`	`0.2`	`0.723`	`0`	`0`	`0`	`0.000`
12	`23`		C	`11`	`2`	`16554`	`◊`	C	-x,-y,z	`2_555`	`11`	`2`	`16554`	`98.2`	`-0.6`	`0.564`	`0`	`0`	`0`	`0.000`
13	`24`		[EDO]A:403	`4`	`1`	`185`	`f`	A	x,y,z	`1_555`	`9`	`5`	`16459`	`94.4`	`1.7`	`0.240`	`1`	`0`	`0`	`0.000`
14	`25`		[EDO]D:403	`4`	`1`	`185`	`f`	D	x,y,z	`1_555`	`17`	`7`	`16653`	`91.3`	`2.6`	`0.295`	`0`	`0`	`0`	`0.000`
15	`26`		[EDO]D:404	`4`	`1`	`184`	`f`	D	x,y,z	`1_555`	`9`	`4`	`16653`	`90.5`	`2.0`	`0.237`	`1`	`0`	`0`	`0.000`
16	`27`		[EDO]D:407	`4`	`1`	`186`	`f`	D	x,y,z	`1_555`	`12`	`4`	`16653`	`84.2`	`1.9`	`0.288`	`4`	`0`	`0`	`0.000`
17	`28`		[EDO]C:406	`4`	`1`	`185`	`◊`	C	x,y,z	`1_555`	`14`	`5`	`16554`	`82.6`	`2.0`	`0.267`	`2`	`0`	`0`	`0.000`
18	`29`		[EDO]A:406	`4`	`1`	`184`	`◊`	A	x,y,z	`1_555`	`11`	`5`	`16459`	`82.3`	`2.4`	`0.477`	`1`	`0`	`0`	`0.000`
19	`30`		[P8V]B:402	`11`	`1`	`845`	`f`	[NAI]B:401	x,y,z	`1_555`	`10`	`1`	`879`	`82.1`	`-3.1`	`0.482`	`0`	`0`	`0`	`0.105`
	`31`		[P8V]D:402	`11`	`1`	`833`	`f`	[NAI]D:401	x,y,z	`1_555`	`11`	`1`	`875`	`81.0`	`-3.0`	`0.497`	`0`	`0`	`0`	`0.105`
	`32`		[P8V]C:402	`10`	`1`	`841`	`f`	[NAI]C:401	x,y,z	`1_555`	`10`	`1`	`876`	`80.9`	`-3.0`	`0.475`	`0`	`0`	`0`	`0.105`
	`33`		[P8V]A:402	`11`	`1`	`836`	`f`	[NAI]A:401	x,y,z	`1_555`	`10`	`1`	`875`	`80.0`	`-3.1`	`0.477`	`0`	`0`	`0`	`0.105`
	*Average:*													`81.0`	`-3.1`	`0.483`	`0`	`0`	`0`	`0.105`
20	`34`		[P8V]D:402	`10`	`1`	`833`	`◊`	A	x,y,z	`1_555`	`10`	`3`	`16459`	`81.6`	`-2.3`	`0.468`	`0`	`0`	`0`	`0.007`
	`35`		[P8V]A:402	`11`	`1`	`836`	`◊`	D	x,y,z	`1_555`	`11`	`3`	`16653`	`75.6`	`-1.9`	`0.548`	`0`	`0`	`0`	`0.007`
	*Average:*													`78.6`	`-2.1`	`0.508`	`0`	`0`	`0`	`0.007`
21	`36`		[EDO]B:403	`4`	`1`	`185`	`f`	B	x,y,z	`1_555`	`14`	`6`	`16166`	`80.7`	`2.0`	`0.287`	`2`	`0`	`0`	`0.000`
22	`37`		A	`7`	`3`	`16459`	`◊`	C	x-1/2,-y+1/2,-z-1	`4_454`	`8`	`4`	`16554`	`80.1`	`1.9`	`0.907`	`1`	`1`	`0`	`0.000`
23	`38`		[EDO]D:407	`4`	`1`	`186`	`◊`	D	-x-1,-y,z	`2_455`	`10`	`4`	`16653`	`75.6`	`2.5`	`0.308`	`1`	`0`	`0`	`0.000`
24	`39`		[EDO]D:405	`4`	`1`	`184`	`◊`	D	x,y,z	`1_555`	`11`	`3`	`16653`	`75.3`	`2.1`	`0.276`	`0`	`0`	`0`	`0.000`
25	`40`		D	`10`	`5`	`16653`	`◊`	B	x,y,z	`1_555`	`9`	`3`	`16166`	`73.5`	`2.0`	`0.915`	`1`	`0`	`0`	`0.000`
26	`41`		D	`12`	`5`	`16653`	`◊`	[EDO]B:403	x-1/2,-y+1/2,-z	`4_455`	`4`	`1`	`185`	`70.0`	`2.1`	`0.286`	`1`	`0`	`0`	`0.000`
27	`42`		[EDO]D:406	`4`	`1`	`182`	`◊`	D	x,y,z	`1_555`	`9`	`5`	`16653`	`67.2`	`2.0`	`0.942`	`2`	`0`	`0`	`0.000`
28	`43`		[EDO]C:403	`4`	`1`	`184`	`f`	[P8V]C:402	x,y,z	`1_555`	`13`	`1`	`841`	`65.3`	`1.5`	`0.309`	`0`	`0`	`0`	`0.000`
29	`44`		[EDO]C:403	`4`	`1`	`184`	`f`	C	x,y,z	`1_555`	`8`	`3`	`16554`	`64.7`	`1.0`	`0.592`	`1`	`0`	`0`	`0.000`
30	`45`		D	`13`	`5`	`16653`	`f`	[EDO]C:406	x-1/2,-y+1/2,-z-1	`4_454`	`4`	`1`	`185`	`64.1`	`1.5`	`0.786`	`1`	`0`	`0`	`0.000`
31	`46`		[EDO]A:406	`3`	`1`	`184`	`f`	C	-x,-y+1,z	`2_565`	`11`	`5`	`16554`	`63.5`	`1.5`	`0.282`	`1`	`0`	`0`	`0.000`
32	`47`		[EDO]A:405	`4`	`1`	`185`	`f`	C	x,y,z	`1_555`	`7`	`4`	`16554`	`63.4`	`1.0`	`0.496`	`0`	`0`	`0`	`0.000`
33	`48`		[EDO]D:404	`4`	`1`	`184`	`f`	[P8V]D:402	x,y,z	`1_555`	`13`	`1`	`833`	`60.3`	`1.4`	`0.304`	`0`	`0`	`0`	`0.000`
34	`49`		[EDO]A:403	`3`	`1`	`185`	`f`	[P8V]A:402	x,y,z	`1_555`	`14`	`1`	`836`	`57.7`	`1.3`	`0.308`	`0`	`0`	`0`	`0.000`
35	`50`		[EDO]A:404	`3`	`1`	`185`	`◊`	C	x,y,z	`1_555`	`8`	`2`	`16554`	`54.9`	`1.8`	`0.262`	`0`	`0`	`0`	`0.000`
36	`51`		B	`7`	`3`	`16166`	`◊`	A	-x,-y+1,z	`2_565`	`4`	`3`	`16459`	`53.8`	`0.1`	`0.657`	`0`	`0`	`0`	`0.000`
37	`52`		[EDO]A:405	`2`	`1`	`185`	`◊`	A	x,y,z	`1_555`	`7`	`4`	`16459`	`47.7`	`1.5`	`0.624`	`0`	`0`	`0`	`0.000`
38	`53`		[EDO]D:405	`2`	`1`	`184`	`f`	C	-x-1/2,y-1/2,-z-1	`3_444`	`2`	`1`	`16554`	`32.4`	`0.3`	`0.378`	`0`	`0`	`0`	`0.000`
39	`54`		[EDO]D:406	`4`	`1`	`182`	`f`	D	-x-1,-y,z	`2_455`	`3`	`1`	`16653`	`30.6`	`0.3`	`0.471`	`0`	`0`	`0`	`0.000`
40	`55`		[EDO]A:404	`2`	`1`	`185`	`◊`	A	x,y,z	`1_555`	`4`	`1`	`16459`	`29.3`	`0.8`	`0.899`	`1`	`0`	`0`	`0.000`
41	`56`		[EDO]D:406	`2`	`1`	`182`	`◊`	B	x-1/2,-y+1/2,-z	`4_455`	`2`	`1`	`16166`	`27.9`	`0.3`	`0.412`	`0`	`0`	`0`	`0.000`
42	`57`		[P8V]D:402	`1`	`1`	`833`	`◊`	[P8V]A:402	x,y,z	`1_555`	`1`	`1`	`836`	`12.4`	`-0.4`	`0.360`	`0`	`0`	`0`	`0.000`
43	`58`		[EDO]A:404	`1`	`1`	`185`	`f`	C	-x,-y+1,z	`2_565`	`1`	`1`	`16554`	`9.4`	`-0.0`	`0.491`	`0`	`0`	`0`	`0.001`
44	`59`		[EDO]D:406	`1`	`1`	`182`	`◊`	B	-x-1/2,y-1/2,-z	`3_445`	`1`	`1`	`16166`	`4.1`	`0.3`	`0.927`	`0`	`0`	`0`	`0.000`
45	`60`		[EDO]D:404	`1`	`1`	`184`	`f`	[NAI]D:401	x,y,z	`1_555`	`1`	`1`	`875`	`3.2`	`-0.1`	`0.571`	`0`	`0`	`0`	`0.001`

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