## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
D |
84 |
23 |
7542 |
◊ |
A |
x,y,z |
1_555 |
80 |
19 |
7797 |
798.2 |
-7.1 |
0.416 |
12 |
0 |
0 |
0.525 |
2 |
|
B |
86 |
21 |
7727 |
◊ |
C |
x,y-1,z |
1_545 |
78 |
19 |
7610 |
761.1 |
-4.9 |
0.587 |
16 |
0 |
0 |
0.525 |
Average: |
779.7 |
-6.0 |
0.501 |
14 |
0 |
0 |
0.525 |
2 |
3 |
|
A |
47 |
11 |
7797 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
48 |
14 |
7542 |
456.8 |
-1.9 |
0.613 |
2 |
2 |
0 |
0.000 |
4 |
|
C |
33 |
9 |
7610 |
◊ |
D |
x-1,y,z |
1_455 |
33 |
8 |
7542 |
314.6 |
-2.2 |
0.526 |
4 |
0 |
0 |
0.000 |
5 |
|
B |
33 |
9 |
7727 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
31 |
6 |
7610 |
297.8 |
-3.7 |
0.362 |
4 |
0 |
0 |
0.000 |
6 |
|
B |
31 |
6 |
7727 |
◊ |
A |
x-1,y,z |
1_455 |
32 |
9 |
7797 |
288.0 |
-3.3 |
0.404 |
4 |
0 |
0 |
0.000 |
Average: |
339.3 |
-2.8 |
0.476 |
4 |
1 |
0 |
0.000 |
3 |
7 |
|
D |
43 |
12 |
7542 |
◊ |
C |
x,y,z |
1_555 |
41 |
12 |
7610 |
399.9 |
-8.6 |
0.101 |
1 |
0 |
0 |
0.016 |
4 |
8 |
|
B |
37 |
12 |
7727 |
◊ |
A |
x,y,z |
1_555 |
35 |
13 |
7797 |
334.2 |
-4.6 |
0.319 |
1 |
2 |
0 |
0.000 |
5 |
9 |
|
C |
34 |
14 |
7610 |
x |
A |
x-1,y,z |
1_455 |
32 |
12 |
7797 |
307.7 |
1.0 |
0.812 |
3 |
3 |
0 |
0.000 |
10 |
|
B |
29 |
9 |
7727 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
31 |
14 |
7727 |
284.9 |
1.2 |
0.760 |
3 |
1 |
0 |
0.000 |
11 |
|
D |
29 |
10 |
7542 |
x |
D |
-x+2,y-1/2,-z+1 |
2_746 |
32 |
14 |
7542 |
263.0 |
1.5 |
0.775 |
1 |
1 |
0 |
0.000 |
12 |
|
C |
22 |
7 |
7610 |
x |
A |
x-1,y+1,z |
1_465 |
27 |
10 |
7797 |
237.2 |
1.3 |
0.796 |
2 |
2 |
0 |
0.000 |
Average: |
273.2 |
1.2 |
0.786 |
2 |
2 |
0 |
0.000 |
6 |
13 |
|
[EAE]B:301 |
17 |
1 |
435 |
f |
B |
x,y,z |
1_555 |
41 |
15 |
7727 |
287.6 |
-2.5 |
0.405 |
2 |
0 |
0 |
0.311 |
14 |
|
[EAE]C:302 |
17 |
1 |
444 |
f |
C |
x,y,z |
1_555 |
42 |
15 |
7610 |
285.1 |
-2.4 |
0.480 |
1 |
0 |
0 |
0.311 |
15 |
|
[EAE]A:305 |
17 |
1 |
437 |
f |
A |
x,y,z |
1_555 |
37 |
14 |
7797 |
283.7 |
-2.7 |
0.455 |
2 |
0 |
0 |
0.311 |
16 |
|
[EAE]D:302 |
17 |
1 |
439 |
f |
D |
x,y,z |
1_555 |
40 |
15 |
7542 |
281.7 |
-2.9 |
0.400 |
2 |
0 |
0 |
0.311 |
Average: |
284.5 |
-2.6 |
0.435 |
2 |
0 |
0 |
0.311 |
7 |
17 |
|
C |
22 |
9 |
7610 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
22 |
8 |
7542 |
205.4 |
-2.8 |
0.376 |
0 |
0 |
0 |
0.000 |
18 |
|
A |
18 |
6 |
7797 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
19 |
7 |
7727 |
190.2 |
-3.1 |
0.312 |
0 |
0 |
0 |
0.000 |
Average: |
197.8 |
-2.9 |
0.344 |
0 |
0 |
0 |
0.000 |
8 |
19 |
|
C |
12 |
4 |
7610 |
f |
[GOL]A:306 |
x-1,y,z |
1_455 |
6 |
1 |
217 |
95.8 |
0.3 |
0.702 |
2 |
0 |
0 |
0.025 |
9 |
20 |
|
C |
14 |
5 |
7610 |
f |
[PO4]A:303 |
x-1,y+1,z |
1_465 |
5 |
1 |
187 |
94.4 |
-4.3 |
0.917 |
2 |
0 |
0 |
0.220 |
10 |
21 |
|
[EAE]A:305 |
6 |
1 |
437 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
7727 |
83.3 |
-0.3 |
0.470 |
0 |
0 |
0 |
0.000 |
11 |
22 |
|
[EDO]A:302 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
7797 |
81.3 |
2.0 |
0.396 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
[EAE]D:302 |
5 |
1 |
439 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
7610 |
73.3 |
-0.2 |
0.501 |
0 |
0 |
0 |
0.000 |
24 |
|
[EAE]C:302 |
6 |
1 |
444 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
7542 |
69.3 |
-0.0 |
0.494 |
0 |
0 |
0 |
0.000 |
Average: |
71.3 |
-0.1 |
0.498 |
0 |
0 |
0 |
0.000 |
13 |
25 |
|
[EDO]D:301 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
7542 |
72.9 |
2.4 |
0.306 |
2 |
0 |
0 |
0.000 |
14 |
26 |
|
[EDO]A:301 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
2 |
7797 |
69.8 |
1.4 |
0.237 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
[EAE]B:301 |
4 |
1 |
435 |
◊ |
A |
x,y,z |
1_555 |
9 |
1 |
7797 |
69.3 |
0.3 |
0.524 |
0 |
0 |
0 |
0.000 |
16 |
28 |
|
[GOL]A:306 |
6 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
7797 |
58.4 |
1.8 |
0.776 |
1 |
0 |
0 |
0.000 |
17 |
29 |
|
[PO4]A:303 |
5 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7797 |
57.5 |
-2.0 |
0.955 |
1 |
0 |
0 |
0.000 |
18 |
30 |
|
[EDO]C:301 |
4 |
1 |
185 |
f |
A |
x-1,y,z |
1_455 |
4 |
2 |
7797 |
54.4 |
1.3 |
0.907 |
2 |
0 |
0 |
0.000 |
19 |
31 |
|
[CL]A:304 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
7797 |
46.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.247 |
20 |
32 |
|
A |
7 |
1 |
7797 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
2 |
7542 |
44.9 |
0.3 |
0.722 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
2 |
1 |
7610 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7727 |
10.4 |
0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
Average: |
27.6 |
0.2 |
0.662 |
0 |
0 |
0 |
0.000 |
21 |
34 |
|
B |
5 |
2 |
7727 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
5 |
2 |
7797 |
44.6 |
-1.2 |
0.308 |
0 |
0 |
0 |
0.000 |
22 |
35 |
|
[EDO]C:301 |
3 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
7610 |
32.9 |
0.7 |
0.842 |
0 |
0 |
0 |
0.000 |
23 |
36 |
|
D |
4 |
2 |
7542 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
2 |
7610 |
31.8 |
-0.4 |
0.515 |
0 |
0 |
0 |
0.000 |
24 |
37 |
|
C |
5 |
2 |
7610 |
◊ |
[CL]A:304 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
28.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
38 |
|
B |
1 |
1 |
7727 |
x |
B |
x,y-1,z |
1_545 |
3 |
2 |
7727 |
18.7 |
1.1 |
0.914 |
0 |
0 |
0 |
0.000 |
39 |
|
A |
2 |
1 |
7797 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
7797 |
7.7 |
-0.2 |
0.383 |
0 |
0 |
0 |
0.000 |
40 |
|
D |
1 |
1 |
7542 |
x |
D |
x,y-1,z |
1_545 |
1 |
1 |
7542 |
0.9 |
0.0 |
0.746 |
0 |
0 |
0 |
0.000 |
Average: |
9.1 |
0.3 |
0.681 |
0 |
0 |
0 |
0.000 |
26 |
41 |
|
[EDO]A:301 |
2 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
7727 |
18.4 |
0.4 |
0.807 |
0 |
0 |
0 |
0.000 |
27 |
42 |
|
[EAE]D:302 |
1 |
1 |
439 |
◊ |
[EAE]C:302 |
x,y,z |
1_555 |
2 |
1 |
444 |
13.8 |
-0.2 |
0.443 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
B |
1 |
1 |
7727 |
f |
[EDO]A:302 |
-x+2,y-1/2,-z |
2_745 |
2 |
1 |
184 |
4.8 |
0.1 |
0.628 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
[EAE]A:305 |
2 |
1 |
437 |
◊ |
[EDO]A:302 |
x,y,z |
1_555 |
2 |
1 |
184 |
3.8 |
0.2 |
0.774 |
0 |
0 |
0 |
0.000 |
|