| ## |
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 |
|
G |
185 |
50 |
11527 |
◊ |
F |
x,y,z |
1_555 |
188 |
49 |
11539 |
1719.3 |
-15.9 |
0.264 |
22 |
2 |
0 |
0.247 |
2 |
|
H |
173 |
48 |
11328 |
◊ |
E |
x,y,z |
1_555 |
170 |
46 |
11330 |
1645.8 |
-13.9 |
0.273 |
20 |
1 |
0 |
0.247 |
3 |
|
D |
171 |
46 |
11228 |
◊ |
A |
x,y,z |
1_555 |
172 |
47 |
11337 |
1563.3 |
-15.2 |
0.231 |
20 |
0 |
0 |
0.247 |
4 |
|
C |
173 |
44 |
11258 |
◊ |
B |
x,y,z |
1_555 |
172 |
46 |
11242 |
1553.0 |
-15.4 |
0.268 |
18 |
0 |
0 |
0.247 |
| Average: |
1620.4 |
-15.1 |
0.259 |
20 |
1 |
0 |
0.247 |
| 2 |
5 |
|
G |
92 |
28 |
11527 |
◊ |
E |
x,y,z |
1_555 |
90 |
26 |
11330 |
860.2 |
-10.6 |
0.172 |
8 |
1 |
0 |
0.107 |
6 |
|
D |
91 |
28 |
11228 |
◊ |
B |
x,y,z |
1_555 |
91 |
27 |
11242 |
820.5 |
-10.9 |
0.164 |
6 |
0 |
0 |
0.107 |
7 |
|
H |
87 |
25 |
11328 |
◊ |
F |
x,y,z |
1_555 |
89 |
24 |
11539 |
809.6 |
-10.7 |
0.146 |
6 |
0 |
0 |
0.107 |
8 |
|
C |
89 |
25 |
11258 |
◊ |
A |
x,y,z |
1_555 |
88 |
24 |
11337 |
806.2 |
-11.8 |
0.107 |
6 |
0 |
0 |
0.107 |
| Average: |
824.1 |
-11.0 |
0.147 |
7 |
0 |
0 |
0.107 |
| 3 |
9 |
|
B |
95 |
29 |
11242 |
◊ |
A |
x,y,z |
1_555 |
94 |
28 |
11337 |
852.2 |
-6.9 |
0.411 |
14 |
8 |
0 |
0.104 |
10 |
|
F |
85 |
26 |
11539 |
◊ |
E |
x,y,z |
1_555 |
83 |
25 |
11330 |
795.8 |
-7.1 |
0.340 |
12 |
8 |
0 |
0.104 |
11 |
|
H |
90 |
28 |
11328 |
◊ |
G |
x,y,z |
1_555 |
87 |
27 |
11527 |
792.8 |
-6.2 |
0.441 |
12 |
8 |
0 |
0.104 |
12 |
|
D |
88 |
26 |
11228 |
◊ |
C |
x,y,z |
1_555 |
83 |
26 |
11258 |
790.2 |
-5.4 |
0.494 |
14 |
8 |
0 |
0.104 |
| Average: |
807.7 |
-6.4 |
0.421 |
13 |
8 |
0 |
0.104 |
| 4 |
13 |
|
F |
58 |
14 |
11539 |
◊ |
E |
x,y-1,z |
1_545 |
61 |
15 |
11330 |
514.0 |
2.1 |
0.853 |
4 |
3 |
0 |
0.000 |
14 |
|
A |
62 |
14 |
11337 |
◊ |
B |
x-1,y-1,z |
1_445 |
56 |
14 |
11242 |
505.4 |
1.1 |
0.827 |
3 |
3 |
0 |
0.000 |
| Average: |
509.7 |
1.6 |
0.840 |
4 |
3 |
0 |
0.000 |
| 5 |
15 |
|
G |
37 |
13 |
11527 |
◊ |
B |
x,y-1,z |
1_545 |
33 |
9 |
11242 |
356.2 |
-4.0 |
0.278 |
3 |
1 |
0 |
0.000 |
16 |
|
F |
35 |
9 |
11539 |
◊ |
C |
x-1,y-1,z |
1_445 |
38 |
12 |
11258 |
350.8 |
-4.0 |
0.296 |
4 |
1 |
0 |
0.000 |
| Average: |
353.5 |
-4.0 |
0.287 |
4 |
1 |
0 |
0.000 |
| 6 |
17 |
|
E |
33 |
8 |
11330 |
◊ |
B |
x,y-1,z+1 |
1_546 |
34 |
9 |
11242 |
254.6 |
-5.3 |
0.162 |
0 |
0 |
0 |
0.000 |
| 7 |
18 |
|
G |
21 |
6 |
11527 |
◊ |
B |
x,y-1,z+1 |
1_546 |
30 |
9 |
11242 |
229.5 |
-0.5 |
0.631 |
3 |
1 |
0 |
0.000 |
| 8 |
19 |
|
D |
26 |
8 |
11228 |
◊ |
H |
x,y,z-1 |
1_554 |
28 |
12 |
11328 |
226.6 |
0.2 |
0.712 |
2 |
1 |
0 |
0.000 |
| 9 |
20 |
|
G |
12 |
4 |
11527 |
◊ |
A |
x,y-1,z+1 |
1_546 |
11 |
6 |
11337 |
95.6 |
-1.5 |
0.329 |
0 |
0 |
0 |
0.000 |
| 10 |
21 |
|
D |
11 |
4 |
11228 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
4 |
11242 |
91.6 |
0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
22 |
|
F |
10 |
3 |
11539 |
◊ |
H |
x-1,y-1,z |
1_445 |
9 |
2 |
11328 |
90.5 |
-0.0 |
0.638 |
0 |
0 |
0 |
0.000 |
| Average: |
91.0 |
0.0 |
0.652 |
0 |
0 |
0 |
0.000 |
| 11 |
23 |
|
E |
8 |
3 |
11330 |
◊ |
H |
x-1,y,z |
1_455 |
9 |
5 |
11328 |
61.0 |
1.1 |
0.771 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
7 |
3 |
11337 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
4 |
11228 |
43.9 |
1.0 |
0.740 |
0 |
0 |
0 |
0.000 |
| Average: |
52.5 |
1.0 |
0.755 |
0 |
0 |
0 |
0.000 |
| 12 |
25 |
|
G |
7 |
3 |
11527 |
◊ |
C |
x,y-1,z |
1_545 |
9 |
4 |
11258 |
59.5 |
-1.1 |
0.327 |
0 |
0 |
0 |
0.000 |
26 |
|
G |
8 |
3 |
11527 |
◊ |
C |
x-1,y-1,z |
1_445 |
6 |
2 |
11258 |
53.6 |
-1.3 |
0.256 |
0 |
0 |
0 |
0.000 |
| Average: |
56.5 |
-1.2 |
0.291 |
0 |
0 |
0 |
0.000 |
| 13 |
27 |
|
[ZN]H:3004 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
13 |
7 |
11328 |
53.2 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.775 |
28 |
|
[ZN]E:3005 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
10 |
7 |
11330 |
51.5 |
-40.3 |
0.000 |
0 |
0 |
0 |
0.775 |
29 |
|
[ZN]D:3008 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
11228 |
51.5 |
-38.8 |
0.000 |
0 |
0 |
0 |
0.775 |
30 |
|
[ZN]A:3001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
11337 |
51.2 |
-40.1 |
0.000 |
0 |
0 |
0 |
0.775 |
31 |
|
[ZN]C:3003 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
7 |
11258 |
50.9 |
-40.1 |
0.000 |
0 |
0 |
0 |
0.775 |
32 |
|
[ZN]G:3007 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
6 |
6 |
11527 |
50.8 |
-39.3 |
0.000 |
0 |
0 |
0 |
0.775 |
33 |
|
[ZN]B:3002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
5 |
11242 |
50.8 |
-39.8 |
0.000 |
0 |
0 |
0 |
0.775 |
34 |
|
[ZN]F:3006 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
7 |
6 |
11539 |
50.6 |
-40.0 |
0.000 |
0 |
0 |
0 |
0.775 |
| Average: |
51.3 |
-39.7 |
0.000 |
0 |
0 |
0 |
0.775 |
| 14 |
35 |
|
D |
3 |
1 |
11228 |
◊ |
E |
x,y,z-1 |
1_554 |
5 |
2 |
11330 |
35.2 |
0.4 |
0.688 |
0 |
0 |
0 |
0.000 |
| 15 |
36 |
|
G |
5 |
2 |
11527 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
11337 |
16.3 |
0.1 |
0.704 |
0 |
0 |
0 |
0.000 |
37 |
|
E |
1 |
1 |
11330 |
◊ |
C |
x-1,y-1,z |
1_445 |
3 |
1 |
11258 |
7.7 |
-0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
| Average: |
12.0 |
0.0 |
0.674 |
0 |
0 |
0 |
0.000 |
| 16 |
38 |
|
H |
1 |
1 |
11328 |
◊ |
B |
x,y-1,z+1 |
1_546 |
2 |
2 |
11242 |
10.8 |
0.3 |
0.809 |
0 |
0 |
0 |
0.000 |
| 17 |
39 |
|
G |
1 |
1 |
11527 |
◊ |
D |
x,y-1,z+1 |
1_546 |
1 |
1 |
11228 |
10.5 |
0.2 |
0.456 |
0 |
0 |
0 |
0.000 |
| 18 |
40 |
|
A |
3 |
1 |
11337 |
◊ |
H |
x-1,y,z-1 |
1_454 |
3 |
1 |
11328 |
8.0 |
-0.1 |
0.574 |
0 |
0 |
0 |
0.000 |
|