| ## |
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 |
|
F |
454 |
115 |
22550 |
◊ |
E |
x,y,z |
1_555 |
462 |
118 |
22543 |
4146.8 |
-45.2 |
0.049 |
76 |
14 |
0 |
0.599 |
2 |
|
B |
455 |
115 |
22579 |
◊ |
A |
x,y,z |
1_555 |
459 |
117 |
22521 |
4142.1 |
-44.9 |
0.054 |
76 |
13 |
0 |
0.599 |
| Average: |
4144.5 |
-45.0 |
0.052 |
76 |
14 |
0 |
0.599 |
| 2 |
3 |
|
F |
130 |
43 |
22550 |
◊ |
A |
x,y,z |
1_555 |
127 |
43 |
22521 |
1245.8 |
-1.5 |
0.804 |
28 |
8 |
0 |
0.243 |
4 |
|
E |
126 |
43 |
22543 |
◊ |
B |
x,y,z |
1_555 |
132 |
43 |
22579 |
1243.4 |
-3.1 |
0.722 |
29 |
8 |
0 |
0.243 |
| Average: |
1244.6 |
-2.3 |
0.763 |
29 |
8 |
0 |
0.243 |
| 3 |
5 |
|
F |
62 |
19 |
22550 |
◊ |
B |
x,y,z |
1_555 |
62 |
19 |
22579 |
651.1 |
-5.8 |
0.313 |
6 |
2 |
0 |
0.055 |
6 |
|
E |
62 |
19 |
22543 |
◊ |
A |
x,y,z |
1_555 |
62 |
19 |
22521 |
645.8 |
-6.0 |
0.298 |
6 |
2 |
0 |
0.055 |
| Average: |
648.5 |
-5.9 |
0.306 |
6 |
2 |
0 |
0.055 |
| 4 |
7 |
|
F |
58 |
24 |
22550 |
◊ |
B |
x,y,z-1 |
1_554 |
57 |
20 |
22579 |
477.5 |
-2.7 |
0.551 |
3 |
5 |
0 |
0.000 |
| 5 |
8 |
|
[DPX]A:600 |
26 |
1 |
597 |
f |
A |
x,y,z |
1_555 |
47 |
20 |
22521 |
325.3 |
-8.2 |
0.505 |
11 |
0 |
0 |
0.389 |
9 |
|
[DPX]F:600 |
26 |
1 |
598 |
f |
F |
x,y,z |
1_555 |
46 |
19 |
22550 |
324.9 |
-8.4 |
0.495 |
11 |
0 |
0 |
0.389 |
10 |
|
[DPX]E:600 |
26 |
1 |
595 |
f |
E |
x,y,z |
1_555 |
47 |
20 |
22543 |
324.0 |
-8.2 |
0.503 |
12 |
0 |
0 |
0.389 |
11 |
|
[DPX]B:600 |
26 |
1 |
595 |
f |
B |
x,y,z |
1_555 |
47 |
19 |
22579 |
322.8 |
-8.3 |
0.505 |
12 |
0 |
0 |
0.389 |
| Average: |
324.3 |
-8.3 |
0.502 |
12 |
0 |
0 |
0.389 |
| 6 |
12 |
|
B |
22 |
7 |
22579 |
◊ |
A |
x,y-1,z |
1_545 |
20 |
6 |
22521 |
214.6 |
-1.9 |
0.389 |
3 |
2 |
0 |
0.000 |
13 |
|
E |
19 |
6 |
22543 |
◊ |
F |
x-1,y-1,z |
1_445 |
25 |
8 |
22550 |
206.0 |
-2.1 |
0.359 |
2 |
2 |
0 |
0.000 |
| Average: |
210.3 |
-2.0 |
0.374 |
3 |
2 |
0 |
0.000 |
| 7 |
14 |
|
E |
16 |
6 |
22543 |
◊ |
B |
x-1,y,z |
1_455 |
14 |
6 |
22579 |
162.8 |
0.8 |
0.787 |
3 |
0 |
0 |
0.000 |
15 |
|
A |
14 |
6 |
22521 |
◊ |
F |
x-1,y,z |
1_455 |
14 |
6 |
22550 |
148.3 |
0.6 |
0.762 |
1 |
0 |
0 |
0.000 |
| Average: |
155.6 |
0.7 |
0.775 |
2 |
0 |
0 |
0.000 |
| 8 |
16 |
|
[CIT]B:610 |
9 |
1 |
315 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
22579 |
136.0 |
1.4 |
0.474 |
4 |
0 |
0 |
0.010 |
17 |
|
[CIT]A:610 |
9 |
1 |
314 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
22521 |
135.8 |
1.4 |
0.476 |
4 |
0 |
0 |
0.010 |
18 |
|
[CIT]F:610 |
9 |
1 |
315 |
◊ |
F |
x,y,z |
1_555 |
19 |
7 |
22550 |
135.6 |
1.4 |
0.474 |
4 |
0 |
0 |
0.010 |
19 |
|
[CIT]E:610 |
9 |
1 |
315 |
◊ |
E |
x,y,z |
1_555 |
19 |
7 |
22543 |
135.3 |
1.5 |
0.476 |
4 |
0 |
0 |
0.010 |
| Average: |
135.7 |
1.5 |
0.475 |
4 |
0 |
0 |
0.010 |
| 9 |
20 |
|
[DPX]A:600 |
10 |
1 |
597 |
◊ |
B |
x,y,z |
1_555 |
17 |
8 |
22579 |
124.4 |
-0.9 |
0.512 |
0 |
0 |
0 |
0.012 |
21 |
|
[DPX]B:600 |
10 |
1 |
595 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
22521 |
124.2 |
-0.8 |
0.503 |
0 |
0 |
0 |
0.012 |
22 |
|
[DPX]E:600 |
10 |
1 |
595 |
◊ |
F |
x,y,z |
1_555 |
17 |
8 |
22550 |
123.7 |
-0.8 |
0.525 |
0 |
0 |
0 |
0.012 |
23 |
|
[DPX]F:600 |
10 |
1 |
598 |
◊ |
E |
x,y,z |
1_555 |
17 |
8 |
22543 |
123.7 |
-0.8 |
0.514 |
0 |
0 |
0 |
0.012 |
| Average: |
124.0 |
-0.8 |
0.513 |
0 |
0 |
0 |
0.012 |
| 10 |
24 |
|
[CIT]F:610 |
9 |
1 |
315 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
22521 |
116.0 |
1.0 |
0.518 |
6 |
0 |
0 |
0.053 |
25 |
|
[CIT]A:610 |
9 |
1 |
314 |
f |
F |
x,y,z |
1_555 |
17 |
6 |
22550 |
115.3 |
1.0 |
0.499 |
6 |
0 |
0 |
0.053 |
26 |
|
[CIT]E:610 |
9 |
1 |
315 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
22579 |
114.8 |
0.8 |
0.503 |
6 |
0 |
0 |
0.053 |
27 |
|
[CIT]B:610 |
9 |
1 |
315 |
f |
E |
x,y,z |
1_555 |
17 |
6 |
22543 |
114.7 |
0.8 |
0.509 |
6 |
0 |
0 |
0.053 |
| Average: |
115.2 |
0.9 |
0.507 |
6 |
0 |
0 |
0.053 |
| 11 |
28 |
|
F |
8 |
2 |
22550 |
x |
F |
x-1,y,z |
1_455 |
8 |
3 |
22550 |
65.1 |
0.5 |
0.764 |
1 |
2 |
0 |
0.000 |
29 |
|
E |
8 |
3 |
22543 |
x |
E |
x-1,y,z |
1_455 |
8 |
2 |
22543 |
61.9 |
0.5 |
0.759 |
1 |
2 |
0 |
0.000 |
30 |
|
B |
8 |
2 |
22579 |
x |
B |
x-1,y,z |
1_455 |
8 |
3 |
22579 |
60.6 |
0.5 |
0.757 |
1 |
2 |
0 |
0.000 |
31 |
|
A |
8 |
3 |
22521 |
x |
A |
x-1,y,z |
1_455 |
8 |
2 |
22521 |
59.1 |
0.6 |
0.765 |
1 |
2 |
0 |
0.000 |
| Average: |
61.7 |
0.5 |
0.761 |
1 |
2 |
0 |
0.000 |
| 12 |
32 |
|
E |
7 |
4 |
22543 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
9 |
3 |
22521 |
50.9 |
-0.6 |
0.471 |
0 |
0 |
0 |
0.000 |
| 13 |
33 |
|
E |
6 |
2 |
22543 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
4 |
2 |
22579 |
47.4 |
1.5 |
0.916 |
0 |
1 |
0 |
0.000 |
| 14 |
34 |
|
[MG]F:601 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
10 |
8 |
22550 |
37.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.182 |
35 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
8 |
22521 |
37.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.182 |
36 |
|
[MG]B:601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
22579 |
37.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.182 |
37 |
|
[MG]E:601 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
10 |
8 |
22543 |
37.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.182 |
| Average: |
37.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.182 |
| 15 |
38 |
|
[DPX]E:600 |
4 |
1 |
595 |
f |
[MG]E:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.146 |
39 |
|
[DPX]B:600 |
4 |
1 |
595 |
f |
[MG]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.146 |
40 |
|
[DPX]F:600 |
4 |
1 |
598 |
f |
[MG]F:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.146 |
41 |
|
[DPX]A:600 |
4 |
1 |
597 |
f |
[MG]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.146 |
| Average: |
30.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.146 |
| 16 |
42 |
|
E |
2 |
1 |
22543 |
◊ |
A |
x,y-1,z-1 |
1_544 |
2 |
1 |
22521 |
14.1 |
0.1 |
0.571 |
0 |
0 |
0 |
0.000 |
| 17 |
43 |
|
E |
2 |
2 |
22543 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
2 |
22521 |
7.6 |
-0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
44 |
|
E |
3 |
2 |
22543 |
◊ |
A |
x-1,y-1,z |
1_445 |
2 |
2 |
22521 |
3.8 |
-0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
| Average: |
5.7 |
-0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
|