| ## |
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 |
|
B |
220 |
65 |
15338 |
◊ |
A |
x,y,z |
1_555 |
222 |
66 |
15423 |
2260.0 |
-38.7 |
0.001 |
19 |
4 |
0 |
0.496 |
2 |
|
D |
222 |
64 |
15371 |
◊ |
C |
x,y,z |
1_555 |
223 |
64 |
15229 |
2186.3 |
-36.7 |
0.002 |
19 |
2 |
0 |
0.496 |
3 |
|
F |
218 |
63 |
15082 |
◊ |
E |
x,y,z |
1_555 |
219 |
63 |
15111 |
2175.8 |
-36.8 |
0.002 |
20 |
2 |
0 |
0.496 |
4 |
|
H |
219 |
62 |
15153 |
◊ |
G |
x,y,z |
1_555 |
221 |
61 |
15141 |
2172.2 |
-36.2 |
0.002 |
22 |
4 |
0 |
0.496 |
| Average: |
2198.6 |
-37.1 |
0.001 |
20 |
3 |
0 |
0.496 |
| 2 |
5 |
|
C |
78 |
20 |
15229 |
◊ |
B |
x,y-1,z |
1_545 |
62 |
18 |
15338 |
647.0 |
-1.4 |
0.660 |
10 |
4 |
0 |
0.000 |
6 |
|
G |
62 |
16 |
15141 |
◊ |
B |
x,y,z |
1_555 |
74 |
19 |
15338 |
640.5 |
-1.1 |
0.679 |
11 |
5 |
0 |
0.000 |
7 |
|
H |
71 |
19 |
15153 |
◊ |
A |
x,y,z |
1_555 |
61 |
16 |
15423 |
639.6 |
-1.3 |
0.658 |
12 |
3 |
0 |
0.000 |
8 |
|
H |
58 |
16 |
15153 |
◊ |
F |
x-1,y+1,z |
1_465 |
71 |
19 |
15082 |
635.9 |
-0.9 |
0.681 |
13 |
5 |
0 |
0.000 |
9 |
|
D |
62 |
18 |
15371 |
◊ |
A |
x,y-1,z |
1_545 |
71 |
20 |
15423 |
631.1 |
-1.4 |
0.656 |
11 |
5 |
0 |
0.000 |
10 |
|
G |
72 |
18 |
15141 |
◊ |
E |
x-1,y+1,z |
1_465 |
60 |
14 |
15111 |
629.9 |
-1.2 |
0.679 |
12 |
4 |
0 |
0.000 |
| Average: |
637.3 |
-1.2 |
0.669 |
12 |
4 |
0 |
0.000 |
| 3 |
11 |
|
[T5K]H:500 |
47 |
1 |
879 |
f |
H |
x,y,z |
1_555 |
80 |
30 |
15153 |
556.1 |
-14.9 |
0.448 |
11 |
0 |
0 |
0.433 |
12 |
|
[T5K]D:500 |
48 |
1 |
877 |
f |
D |
x,y,z |
1_555 |
76 |
29 |
15371 |
555.5 |
-15.0 |
0.443 |
14 |
0 |
0 |
0.433 |
13 |
|
[T5K]C:500 |
47 |
1 |
887 |
f |
C |
x,y,z |
1_555 |
74 |
29 |
15229 |
552.6 |
-15.2 |
0.432 |
12 |
0 |
0 |
0.433 |
14 |
|
[T5K]G:500 |
47 |
1 |
877 |
f |
G |
x,y,z |
1_555 |
75 |
28 |
15141 |
551.4 |
-15.1 |
0.426 |
13 |
0 |
0 |
0.433 |
15 |
|
[T5K]E:500 |
47 |
1 |
860 |
f |
E |
x,y,z |
1_555 |
78 |
28 |
15111 |
550.5 |
-14.4 |
0.468 |
10 |
0 |
0 |
0.433 |
16 |
|
[T5K]F:500 |
47 |
1 |
868 |
f |
F |
x,y,z |
1_555 |
76 |
28 |
15082 |
549.1 |
-14.7 |
0.443 |
9 |
0 |
0 |
0.433 |
17 |
|
[T5K]A:500 |
48 |
1 |
869 |
cf |
A |
x,y,z |
1_555 |
73 |
29 |
15423 |
546.4 |
-14.8 |
0.453 |
13 |
0 |
0 |
0.433 |
18 |
|
[T5K]B:500 |
48 |
1 |
866 |
f |
B |
x,y,z |
1_555 |
75 |
29 |
15338 |
545.4 |
-14.5 |
0.435 |
13 |
0 |
0 |
0.433 |
| Average: |
550.9 |
-14.8 |
0.444 |
12 |
0 |
0 |
0.433 |
| 4 |
19 |
|
A |
40 |
10 |
15423 |
◊ |
E |
x-1,y,z+1 |
1_456 |
42 |
13 |
15111 |
384.9 |
-3.4 |
0.377 |
1 |
1 |
0 |
0.000 |
| 5 |
20 |
|
E |
45 |
13 |
15111 |
◊ |
C |
x,y,z |
1_555 |
38 |
12 |
15229 |
370.9 |
0.2 |
0.704 |
5 |
3 |
0 |
0.000 |
21 |
|
F |
39 |
13 |
15082 |
◊ |
D |
x,y,z |
1_555 |
40 |
13 |
15371 |
349.2 |
-0.3 |
0.663 |
7 |
3 |
0 |
0.000 |
| Average: |
360.0 |
-0.1 |
0.683 |
6 |
3 |
0 |
0.000 |
| 6 |
22 |
|
D |
28 |
9 |
15371 |
◊ |
A |
x,y,z |
1_555 |
38 |
13 |
15423 |
274.1 |
1.2 |
0.792 |
2 |
0 |
0 |
0.000 |
23 |
|
C |
33 |
13 |
15229 |
◊ |
B |
x,y,z |
1_555 |
31 |
11 |
15338 |
273.9 |
0.7 |
0.748 |
0 |
0 |
0 |
0.000 |
| Average: |
274.0 |
1.0 |
0.770 |
1 |
0 |
0 |
0.000 |
| 7 |
24 |
|
D |
24 |
7 |
15371 |
◊ |
E |
x-1,y,z+1 |
1_456 |
22 |
10 |
15111 |
207.4 |
1.2 |
0.776 |
0 |
0 |
0 |
0.000 |
| 8 |
25 |
|
[T5K]C:500 |
23 |
1 |
887 |
◊ |
D |
x,y,z |
1_555 |
19 |
7 |
15371 |
183.7 |
-2.6 |
0.839 |
5 |
0 |
0 |
0.103 |
26 |
|
[T5K]A:500 |
24 |
1 |
869 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
15338 |
179.3 |
-3.0 |
0.804 |
6 |
0 |
0 |
0.103 |
27 |
|
[T5K]G:500 |
23 |
1 |
877 |
◊ |
H |
x,y,z |
1_555 |
22 |
6 |
15153 |
174.0 |
-3.4 |
0.727 |
3 |
0 |
0 |
0.103 |
28 |
|
[T5K]H:500 |
22 |
1 |
879 |
◊ |
G |
x,y,z |
1_555 |
17 |
5 |
15141 |
165.6 |
-4.0 |
0.604 |
2 |
0 |
0 |
0.103 |
29 |
|
[T5K]B:500 |
23 |
1 |
866 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
15423 |
165.6 |
-3.2 |
0.737 |
3 |
0 |
0 |
0.103 |
30 |
|
[T5K]D:500 |
22 |
1 |
877 |
◊ |
C |
x,y,z |
1_555 |
19 |
6 |
15229 |
162.2 |
-3.1 |
0.733 |
3 |
0 |
0 |
0.103 |
31 |
|
[T5K]E:500 |
23 |
1 |
860 |
◊ |
F |
x,y,z |
1_555 |
19 |
7 |
15082 |
160.4 |
-3.3 |
0.750 |
5 |
0 |
0 |
0.103 |
32 |
|
[T5K]F:500 |
23 |
1 |
868 |
◊ |
E |
x,y,z |
1_555 |
16 |
6 |
15111 |
154.2 |
-2.3 |
0.845 |
3 |
0 |
0 |
0.103 |
| Average: |
168.1 |
-3.1 |
0.755 |
4 |
0 |
0 |
0.103 |
| 9 |
33 |
|
F |
10 |
4 |
15082 |
◊ |
B |
x,y,z-1 |
1_554 |
14 |
7 |
15338 |
100.3 |
1.3 |
0.744 |
1 |
1 |
0 |
0.000 |
| 10 |
34 |
|
G |
9 |
6 |
15141 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
15082 |
53.6 |
1.0 |
0.817 |
0 |
0 |
0 |
0.000 |
| 11 |
35 |
|
F |
3 |
1 |
15082 |
◊ |
C |
x,y,z-1 |
1_554 |
10 |
3 |
15229 |
46.8 |
-0.7 |
0.334 |
0 |
0 |
0 |
0.000 |
| 12 |
36 |
|
H |
13 |
4 |
15153 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
15111 |
46.7 |
0.4 |
0.705 |
0 |
0 |
0 |
0.000 |
| 13 |
37 |
|
H |
2 |
1 |
15153 |
◊ |
E |
x-1,y+1,z |
1_465 |
2 |
1 |
15111 |
33.9 |
-0.7 |
0.181 |
0 |
0 |
0 |
0.000 |
38 |
|
G |
2 |
1 |
15141 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
15423 |
31.3 |
-0.4 |
0.334 |
0 |
0 |
0 |
0.000 |
39 |
|
D |
2 |
1 |
15371 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
15338 |
29.3 |
0.0 |
0.630 |
0 |
0 |
0 |
0.000 |
| Average: |
31.5 |
-0.4 |
0.382 |
0 |
0 |
0 |
0.000 |
| 14 |
40 |
|
D |
2 |
2 |
15371 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
15338 |
30.3 |
1.4 |
0.942 |
0 |
1 |
0 |
0.000 |
| 15 |
41 |
|
H |
2 |
1 |
15153 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
15082 |
28.7 |
1.2 |
0.844 |
1 |
2 |
0 |
0.000 |
| 16 |
42 |
|
F |
2 |
1 |
15082 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
15229 |
19.3 |
0.1 |
0.535 |
0 |
0 |
0 |
0.000 |
| 17 |
43 |
|
H |
3 |
1 |
15153 |
◊ |
G |
x-1,y,z |
1_455 |
4 |
2 |
15141 |
12.4 |
-0.1 |
0.588 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
2 |
2 |
15423 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
15338 |
11.6 |
-0.1 |
0.568 |
0 |
0 |
0 |
0.000 |
| Average: |
12.0 |
-0.1 |
0.578 |
0 |
0 |
0 |
0.000 |
| 18 |
45 |
|
F |
1 |
1 |
15082 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
15111 |
4.2 |
0.0 |
0.525 |
0 |
0 |
0 |
0.000 |
|