## |
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 |
128 |
34 |
21090 |
◊ |
A |
x,y,z |
1_555 |
125 |
34 |
20900 |
1137.2 |
-8.6 |
0.529 |
11 |
0 |
0 |
0.103 |
2 |
|
D |
126 |
33 |
20974 |
◊ |
B |
x,y,z |
1_555 |
123 |
33 |
21045 |
1108.8 |
-10.2 |
0.433 |
10 |
0 |
0 |
0.103 |
Average: |
1123.0 |
-9.4 |
0.481 |
11 |
0 |
0 |
0.103 |
2 |
3 |
|
D |
81 |
21 |
20974 |
◊ |
A |
x,y,z |
1_555 |
83 |
21 |
20900 |
883.1 |
-17.1 |
0.011 |
2 |
4 |
0 |
0.176 |
4 |
|
C |
80 |
21 |
21090 |
◊ |
B |
x,y,z |
1_555 |
79 |
20 |
21045 |
879.7 |
-16.6 |
0.011 |
3 |
4 |
0 |
0.176 |
Average: |
881.4 |
-16.9 |
0.011 |
3 |
4 |
0 |
0.176 |
3 |
5 |
|
[FDA]D:601 |
52 |
1 |
1015 |
f |
D |
x,y,z |
1_555 |
105 |
43 |
20974 |
709.7 |
-7.3 |
0.595 |
18 |
0 |
0 |
0.296 |
6 |
|
[FDA]C:601 |
51 |
1 |
1012 |
f |
C |
x,y,z |
1_555 |
103 |
42 |
21090 |
708.2 |
-7.2 |
0.595 |
17 |
0 |
0 |
0.296 |
7 |
|
[FDA]B:601 |
52 |
1 |
1007 |
f |
B |
x,y,z |
1_555 |
109 |
42 |
21045 |
707.0 |
-7.6 |
0.597 |
20 |
0 |
0 |
0.296 |
8 |
|
[FDA]A:601 |
51 |
1 |
1007 |
f |
A |
x,y,z |
1_555 |
106 |
43 |
20900 |
703.4 |
-7.0 |
0.594 |
17 |
0 |
0 |
0.296 |
Average: |
707.1 |
-7.3 |
0.595 |
18 |
0 |
0 |
0.296 |
4 |
9 |
|
C |
59 |
19 |
21090 |
◊ |
D |
x-y,x,z-1/6 |
6_554 |
61 |
19 |
20974 |
566.0 |
-5.2 |
0.431 |
2 |
0 |
0 |
0.000 |
5 |
10 |
|
B |
47 |
17 |
21045 |
◊ |
B |
-y+1,-x+1,-z+7/6 |
10_666 |
48 |
17 |
21045 |
352.4 |
-3.9 |
0.458 |
2 |
0 |
0 |
0.041 |
6 |
11 |
|
D |
32 |
12 |
20974 |
◊ |
A |
-y+1,-x+1,-z+7/6 |
10_666 |
44 |
16 |
20900 |
343.2 |
-1.9 |
0.598 |
6 |
1 |
0 |
0.016 |
7 |
12 |
|
A |
39 |
14 |
20900 |
◊ |
A |
-y+1,-x+1,-z+7/6 |
10_666 |
39 |
14 |
20900 |
244.7 |
-3.7 |
0.411 |
0 |
0 |
0 |
0.006 |
8 |
13 |
|
A |
17 |
7 |
20900 |
◊ |
B |
x-y+1,x,z-1/6 |
6_654 |
22 |
7 |
21045 |
196.5 |
-2.6 |
0.317 |
2 |
0 |
0 |
0.000 |
9 |
14 |
|
B |
14 |
6 |
21045 |
◊ |
A |
-y+1,-x+1,-z+7/6 |
10_666 |
25 |
8 |
20900 |
187.8 |
-0.0 |
0.735 |
3 |
0 |
0 |
0.005 |
10 |
15 |
|
C |
8 |
4 |
21090 |
◊ |
B |
-y+1,-x+1,-z+7/6 |
10_666 |
14 |
5 |
21045 |
111.1 |
-1.9 |
0.264 |
0 |
0 |
0 |
0.016 |
11 |
16 |
|
[SO4]C:603 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
21090 |
89.3 |
-13.2 |
0.831 |
4 |
0 |
0 |
0.141 |
12 |
17 |
|
[SO4]D:603 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
20974 |
87.6 |
-12.6 |
0.782 |
3 |
0 |
0 |
0.101 |
13 |
18 |
|
[SO4]A:603 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
20900 |
85.6 |
-9.0 |
0.975 |
5 |
0 |
0 |
0.081 |
14 |
19 |
|
[SO4]B:604 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
21045 |
85.4 |
-12.2 |
0.837 |
3 |
0 |
0 |
0.229 |
15 |
20 |
|
[SO4]A:604 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
20900 |
84.7 |
-12.3 |
0.789 |
3 |
0 |
0 |
0.099 |
16 |
21 |
|
[SO4]A:602 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20900 |
74.3 |
-10.5 |
0.649 |
1 |
0 |
0 |
0.079 |
17 |
22 |
|
[SO4]D:602 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
20974 |
71.7 |
-9.4 |
0.947 |
4 |
0 |
0 |
0.081 |
18 |
23 |
|
[SO4]D:604 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
20974 |
70.6 |
-9.7 |
0.752 |
2 |
0 |
0 |
0.077 |
19 |
24 |
|
[SO4]A:606 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
20900 |
69.5 |
-9.8 |
0.733 |
3 |
0 |
0 |
0.080 |
20 |
25 |
|
[SO4]B:603 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
21045 |
67.7 |
-9.8 |
0.594 |
2 |
0 |
0 |
0.180 |
21 |
26 |
|
[SO4]C:602 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
21090 |
66.6 |
-9.6 |
0.586 |
1 |
0 |
0 |
0.095 |
22 |
27 |
|
[SO4]B:603 |
4 |
1 |
186 |
◊ |
B |
-y+1,-x+1,-z+7/6 |
10_666 |
7 |
3 |
21045 |
63.7 |
-8.6 |
0.804 |
2 |
0 |
0 |
0.160 |
23 |
28 |
|
[SO4]A:605 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
20900 |
52.8 |
-5.8 |
0.963 |
3 |
0 |
0 |
0.052 |
24 |
29 |
|
[SO4]B:602 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
21045 |
51.6 |
-5.7 |
0.947 |
2 |
0 |
0 |
0.111 |
25 |
30 |
|
B |
5 |
1 |
21045 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
20900 |
37.3 |
-1.0 |
0.222 |
0 |
0 |
0 |
0.007 |
31 |
|
D |
5 |
1 |
20974 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
21090 |
36.4 |
-1.0 |
0.222 |
0 |
0 |
0 |
0.007 |
Average: |
36.9 |
-1.0 |
0.222 |
0 |
0 |
0 |
0.007 |
|