## |
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 |
|
C |
151 |
39 |
11034 |
◊ |
B |
x,y,z |
1_555 |
159 |
40 |
9771 |
1585.2 |
-25.8 |
0.025 |
9 |
8 |
0 |
0.447 |
2 |
|
D |
158 |
41 |
9739 |
◊ |
A |
x,y,z |
1_555 |
151 |
38 |
10268 |
1577.1 |
-25.7 |
0.012 |
11 |
10 |
0 |
0.447 |
Average: |
1581.1 |
-25.7 |
0.018 |
10 |
9 |
0 |
0.447 |
2 |
3 |
|
C |
164 |
46 |
11034 |
◊ |
A |
x,y,z |
1_555 |
163 |
44 |
10268 |
1534.2 |
-11.2 |
0.435 |
26 |
0 |
0 |
0.243 |
4 |
|
D |
144 |
42 |
9739 |
◊ |
B |
x,y,z |
1_555 |
144 |
39 |
9771 |
1293.7 |
-7.6 |
0.509 |
24 |
0 |
0 |
0.243 |
Average: |
1414.0 |
-9.4 |
0.472 |
25 |
0 |
0 |
0.243 |
3 |
5 |
|
C |
43 |
14 |
11034 |
◊ |
A |
-y,x,z-1/4 |
3_554 |
41 |
9 |
10268 |
384.5 |
1.7 |
0.831 |
1 |
0 |
0 |
0.000 |
4 |
6 |
|
A |
37 |
13 |
10268 |
x |
A |
-y,x,z-1/4 |
3_554 |
35 |
10 |
10268 |
377.6 |
-2.0 |
0.468 |
4 |
0 |
0 |
0.000 |
5 |
7 |
|
C |
36 |
9 |
11034 |
◊ |
B |
x,y-1,z |
1_545 |
41 |
12 |
9771 |
369.9 |
-3.1 |
0.412 |
3 |
0 |
0 |
0.005 |
6 |
8 |
|
D |
37 |
13 |
9739 |
◊ |
A |
-y-1,x,z-1/4 |
3_454 |
30 |
10 |
10268 |
325.9 |
-2.1 |
0.474 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
D |
32 |
10 |
9739 |
◊ |
C |
-x-1,-y,z-1/2 |
2_454 |
25 |
9 |
11034 |
268.2 |
-4.6 |
0.207 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
30 |
7 |
9771 |
◊ |
C |
-y-1,x+1,z-1/4 |
3_464 |
26 |
8 |
11034 |
235.8 |
-2.1 |
0.468 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
D |
22 |
9 |
9739 |
◊ |
C |
x,y,z |
1_555 |
22 |
8 |
11034 |
209.7 |
-1.8 |
0.341 |
2 |
0 |
0 |
0.014 |
12 |
|
B |
11 |
5 |
9771 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
10268 |
85.6 |
0.4 |
0.682 |
2 |
0 |
0 |
0.014 |
Average: |
147.7 |
-0.7 |
0.511 |
2 |
0 |
0 |
0.014 |
10 |
13 |
|
B |
24 |
7 |
9771 |
◊ |
D |
-y,x+1,z-1/4 |
3_564 |
20 |
7 |
9739 |
188.1 |
-1.2 |
0.504 |
3 |
0 |
0 |
0.000 |
11 |
14 |
|
B |
24 |
7 |
9771 |
x |
B |
-y,x+1,z-1/4 |
3_564 |
18 |
6 |
9771 |
165.7 |
0.9 |
0.671 |
1 |
1 |
0 |
0.000 |
12 |
15 |
|
D |
14 |
4 |
9739 |
◊ |
B |
-y,x+1,z-1/4 |
3_564 |
10 |
5 |
9771 |
145.9 |
-3.1 |
0.106 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
D |
16 |
5 |
9739 |
◊ |
C |
-y-1,x+1,z-1/4 |
3_464 |
12 |
4 |
11034 |
126.1 |
0.7 |
0.597 |
1 |
0 |
0 |
0.000 |
14 |
17 |
|
[SO4]B:4 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
9771 |
95.5 |
-14.1 |
0.663 |
3 |
0 |
0 |
0.204 |
15 |
18 |
|
[SO4]C:7 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
12 |
3 |
11034 |
94.5 |
-14.9 |
0.699 |
5 |
0 |
0 |
0.182 |
16 |
19 |
|
[SO4]B:3 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
9771 |
88.1 |
-12.6 |
0.784 |
4 |
0 |
0 |
0.191 |
17 |
20 |
|
[SO4]D:2 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
9739 |
87.8 |
-12.8 |
0.745 |
4 |
0 |
0 |
0.202 |
21 |
|
[SO4]C:10 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
11034 |
87.0 |
-12.4 |
0.792 |
4 |
0 |
0 |
0.202 |
Average: |
87.4 |
-12.6 |
0.769 |
4 |
0 |
0 |
0.202 |
18 |
22 |
|
[SO4]A:1 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10268 |
87.5 |
-13.1 |
0.751 |
3 |
0 |
0 |
0.201 |
19 |
23 |
|
[SO4]A:8 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
10268 |
73.9 |
-9.9 |
0.919 |
2 |
0 |
0 |
0.150 |
20 |
24 |
|
B |
6 |
3 |
9771 |
f |
[SO4]B:6 |
-y,x+1,z-1/4 |
3_564 |
5 |
1 |
184 |
72.4 |
-9.5 |
0.915 |
3 |
0 |
0 |
0.143 |
21 |
25 |
|
[SO4]B:6 |
5 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
9771 |
66.2 |
-8.9 |
0.763 |
2 |
0 |
0 |
0.000 |
22 |
26 |
|
[SO4]C:9 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
11034 |
63.7 |
-8.4 |
0.851 |
2 |
0 |
0 |
0.099 |
23 |
27 |
|
A |
8 |
2 |
10268 |
◊ |
C |
-y-1,x,z-1/4 |
3_454 |
8 |
2 |
11034 |
61.9 |
-0.4 |
0.554 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
C |
6 |
3 |
11034 |
◊ |
[SO4]B:4 |
x,y-1,z |
1_545 |
5 |
1 |
185 |
50.2 |
-5.1 |
0.944 |
2 |
0 |
0 |
0.007 |
25 |
29 |
|
C |
4 |
1 |
11034 |
◊ |
D |
-y,x,z-1/4 |
3_554 |
6 |
1 |
9739 |
45.0 |
1.1 |
0.857 |
0 |
1 |
0 |
0.000 |
26 |
30 |
|
C |
7 |
2 |
11034 |
x |
C |
-y,x+1,z-1/4 |
3_564 |
2 |
1 |
11034 |
37.5 |
0.3 |
0.721 |
0 |
1 |
0 |
0.000 |
27 |
31 |
|
D |
5 |
2 |
9739 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
2 |
10268 |
35.7 |
-0.2 |
0.558 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
B |
4 |
2 |
9771 |
◊ |
C |
-y,x+1,z-1/4 |
3_564 |
6 |
3 |
11034 |
34.8 |
0.5 |
0.753 |
1 |
0 |
0 |
0.000 |
29 |
33 |
|
A |
5 |
2 |
10268 |
◊ |
[SO4]A:8 |
-y,x,z-1/4 |
3_554 |
3 |
1 |
185 |
32.7 |
-4.3 |
0.674 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[SO4]C:9 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
10268 |
32.0 |
-3.2 |
0.898 |
0 |
0 |
0 |
0.034 |
31 |
35 |
|
B |
7 |
2 |
9771 |
◊ |
A |
-y,x,z-1/4 |
3_554 |
6 |
1 |
10268 |
31.4 |
0.7 |
0.768 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
B |
3 |
1 |
9771 |
◊ |
C |
-y-1,x,z-1/4 |
3_454 |
3 |
1 |
11034 |
24.7 |
-0.5 |
0.385 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
D |
4 |
1 |
9739 |
◊ |
C |
-y-1,x,z-1/4 |
3_454 |
3 |
1 |
11034 |
19.8 |
-0.1 |
0.502 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
[SO4]C:7 |
2 |
1 |
185 |
◊ |
A |
-y,x,z-1/4 |
3_554 |
3 |
2 |
10268 |
19.6 |
-2.2 |
0.822 |
0 |
0 |
0 |
0.000 |
35 |
39 |
|
[SO4]A:1 |
1 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
11034 |
15.7 |
-1.4 |
0.854 |
0 |
0 |
0 |
0.015 |
36 |
40 |
|
[SO4]D:2 |
1 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
9771 |
13.3 |
-1.2 |
0.841 |
0 |
0 |
0 |
0.016 |
41 |
|
[SO4]C:10 |
1 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
10268 |
7.4 |
-0.6 |
0.814 |
0 |
0 |
0 |
0.016 |
Average: |
10.3 |
-0.9 |
0.827 |
0 |
0 |
0 |
0.016 |
37 |
42 |
|
[SO4]B:3 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
9739 |
8.4 |
-0.7 |
0.856 |
0 |
0 |
0 |
0.010 |
38 |
43 |
|
[SO4]D:2 |
1 |
1 |
184 |
◊ |
B |
-y,x+1,z-1/4 |
3_564 |
3 |
1 |
9771 |
6.5 |
-0.9 |
0.660 |
0 |
0 |
0 |
0.000 |
39 |
44 |
|
[SO4]C:7 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9771 |
6.0 |
-0.6 |
0.808 |
0 |
0 |
0 |
0.006 |
40 |
45 |
|
D |
1 |
1 |
9739 |
◊ |
[SO4]B:6 |
-y,x+1,z-1/4 |
3_564 |
1 |
1 |
184 |
1.1 |
-0.2 |
0.725 |
0 |
0 |
0 |
0.002 |
|