## |
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 |
|
D |
65 |
21 |
13949 |
◊ |
A |
x-1,y,z |
1_455 |
68 |
22 |
14423 |
691.1 |
-8.8 |
0.231 |
7 |
0 |
0 |
0.102 |
2 |
|
C |
30 |
11 |
14123 |
◊ |
B |
x,y-1,z |
1_545 |
25 |
9 |
13552 |
295.2 |
-6.2 |
0.084 |
2 |
0 |
0 |
0.102 |
Average: |
493.1 |
-7.5 |
0.157 |
5 |
0 |
0 |
0.102 |
2 |
3 |
|
C |
76 |
23 |
14123 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
71 |
20 |
14423 |
684.0 |
-6.1 |
0.244 |
6 |
1 |
0 |
0.000 |
4 |
|
C |
63 |
17 |
14123 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
62 |
19 |
14423 |
612.4 |
-7.5 |
0.147 |
4 |
0 |
0 |
0.000 |
Average: |
648.2 |
-6.8 |
0.195 |
5 |
1 |
0 |
0.000 |
3 |
5 |
|
D |
64 |
21 |
13949 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
59 |
17 |
14423 |
576.8 |
-5.1 |
0.484 |
4 |
7 |
0 |
0.007 |
6 |
|
C |
48 |
14 |
14123 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
58 |
18 |
13552 |
547.6 |
-5.5 |
0.327 |
5 |
8 |
0 |
0.007 |
Average: |
562.2 |
-5.3 |
0.406 |
5 |
8 |
0 |
0.007 |
4 |
7 |
|
D |
56 |
19 |
13949 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
56 |
17 |
13552 |
503.4 |
-7.4 |
0.229 |
5 |
1 |
0 |
0.000 |
5 |
8 |
|
[RTJ]A:401 |
29 |
1 |
574 |
f |
A |
x,y,z |
1_555 |
57 |
22 |
14423 |
416.1 |
2.0 |
0.521 |
5 |
0 |
0 |
0.000 |
9 |
|
[RTJ]B:401 |
29 |
1 |
579 |
f |
B |
x,y,z |
1_555 |
59 |
21 |
13552 |
387.4 |
2.8 |
0.561 |
4 |
0 |
0 |
0.000 |
10 |
|
[RTJ]D:401 |
29 |
1 |
565 |
f |
D |
x,y,z |
1_555 |
51 |
21 |
13949 |
374.6 |
2.3 |
0.531 |
4 |
0 |
0 |
0.000 |
Average: |
392.7 |
2.4 |
0.538 |
4 |
0 |
0 |
0.001 |
6 |
11 |
|
[VBD]C:401 |
27 |
1 |
577 |
f |
C |
x,y,z |
1_555 |
47 |
19 |
14123 |
345.4 |
3.3 |
0.544 |
6 |
0 |
0 |
0.000 |
7 |
12 |
|
C |
32 |
13 |
14123 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
41 |
14 |
13949 |
332.9 |
-2.0 |
0.550 |
6 |
0 |
0 |
0.000 |
8 |
13 |
|
B |
24 |
8 |
13552 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
6 |
14423 |
223.7 |
-1.1 |
0.562 |
2 |
0 |
0 |
0.000 |
9 |
14 |
|
D |
22 |
8 |
13949 |
◊ |
C |
x,y,z |
1_555 |
18 |
7 |
14123 |
184.0 |
-0.5 |
0.646 |
1 |
1 |
0 |
0.000 |
15 |
|
B |
21 |
6 |
13552 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
14423 |
158.6 |
-1.2 |
0.540 |
1 |
0 |
0 |
0.000 |
Average: |
171.3 |
-0.8 |
0.593 |
1 |
1 |
0 |
0.000 |
10 |
16 |
|
[SO4]D:406 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
13949 |
101.4 |
-16.0 |
0.794 |
4 |
0 |
0 |
0.152 |
11 |
17 |
|
[GOL]C:405 |
6 |
1 |
217 |
f |
B |
-x,y-1/2,-z+1/2 |
3_545 |
17 |
4 |
13552 |
90.4 |
-0.9 |
0.521 |
2 |
0 |
0 |
0.006 |
12 |
18 |
|
[GOL]C:405 |
6 |
1 |
217 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
14123 |
81.9 |
1.4 |
0.780 |
3 |
0 |
0 |
0.000 |
13 |
19 |
|
[SO4]D:407 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
13949 |
81.2 |
-10.5 |
0.919 |
3 |
0 |
0 |
0.101 |
14 |
20 |
|
[SO4]B:403 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
13552 |
80.0 |
-9.6 |
0.966 |
2 |
0 |
0 |
0.033 |
15 |
21 |
|
[SO4]D:404 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
13949 |
77.4 |
-9.7 |
0.947 |
3 |
0 |
0 |
0.094 |
16 |
22 |
|
D |
5 |
2 |
13949 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
9 |
4 |
13949 |
75.9 |
-1.5 |
0.197 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[SO4]B:404 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
13552 |
74.7 |
-9.3 |
0.938 |
3 |
0 |
0 |
0.033 |
18 |
24 |
|
[SO4]D:402 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
13949 |
74.4 |
-9.3 |
0.937 |
3 |
0 |
0 |
0.091 |
19 |
25 |
|
[SO4]C:403 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
14123 |
73.7 |
-9.7 |
0.853 |
2 |
0 |
0 |
0.052 |
20 |
26 |
|
[SO4]C:404 |
5 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
14123 |
73.4 |
-9.1 |
0.946 |
3 |
0 |
0 |
0.051 |
21 |
27 |
|
[SO4]A:403 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
14423 |
70.7 |
-8.2 |
0.964 |
3 |
0 |
0 |
0.082 |
22 |
28 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
13552 |
70.6 |
-9.3 |
0.868 |
2 |
0 |
0 |
0.032 |
23 |
29 |
|
[SO4]D:403 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
13949 |
68.0 |
-8.8 |
0.874 |
2 |
0 |
0 |
0.083 |
24 |
30 |
|
[SO4]A:402 |
5 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14423 |
68.0 |
-8.8 |
0.891 |
2 |
0 |
0 |
0.083 |
25 |
31 |
|
[SO4]D:405 |
4 |
1 |
184 |
f |
A |
x-1,y,z |
1_455 |
12 |
5 |
14423 |
67.5 |
-9.0 |
0.876 |
2 |
0 |
0 |
0.085 |
26 |
32 |
|
[SO4]D:405 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
13949 |
56.0 |
-7.5 |
0.818 |
0 |
0 |
0 |
0.064 |
27 |
33 |
|
[SO4]C:402 |
4 |
1 |
183 |
f |
D |
x-1/2,-y-1/2,-z |
4_445 |
5 |
3 |
13949 |
50.3 |
-7.3 |
0.545 |
1 |
0 |
0 |
0.066 |
28 |
34 |
|
[SO4]C:402 |
5 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
14123 |
47.6 |
-6.6 |
0.661 |
1 |
0 |
0 |
0.000 |
29 |
35 |
|
[SO4]D:404 |
4 |
1 |
185 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
4 |
2 |
14423 |
41.6 |
-3.4 |
0.990 |
3 |
0 |
0 |
0.004 |
30 |
36 |
|
C |
1 |
1 |
14123 |
◊ |
[SO4]D:402 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
184 |
0.7 |
-0.1 |
0.827 |
0 |
0 |
0 |
0.000 |
|