## |
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 |
318 |
78 |
10259 |
◊ |
A |
x,y,z |
1_555 |
319 |
74 |
10204 |
3438.6 |
-45.2 |
0.049 |
37 |
16 |
0 |
0.627 |
2 |
|
D |
313 |
76 |
10240 |
◊ |
B |
x,y,z |
1_555 |
310 |
73 |
10115 |
3419.1 |
-46.9 |
0.035 |
37 |
15 |
0 |
0.627 |
Average: |
3428.8 |
-46.1 |
0.042 |
37 |
16 |
0 |
0.627 |
2 |
3 |
|
B |
81 |
18 |
10115 |
◊ |
C |
x-1,y,z |
1_455 |
78 |
21 |
10259 |
712.1 |
-6.5 |
0.462 |
11 |
3 |
0 |
0.190 |
4 |
|
D |
78 |
21 |
10240 |
◊ |
A |
x,y,z |
1_555 |
75 |
18 |
10204 |
711.8 |
-7.4 |
0.392 |
9 |
4 |
0 |
0.190 |
Average: |
712.0 |
-7.0 |
0.427 |
10 |
4 |
0 |
0.190 |
3 |
5 |
|
C |
32 |
9 |
10259 |
x |
C |
-x+1,y-1/2,-z+2 |
2_647 |
50 |
13 |
10259 |
400.0 |
-5.9 |
0.266 |
2 |
2 |
0 |
0.000 |
6 |
|
D |
52 |
13 |
10240 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
32 |
9 |
10240 |
391.4 |
-5.8 |
0.286 |
1 |
2 |
0 |
0.000 |
Average: |
395.7 |
-5.9 |
0.276 |
2 |
2 |
0 |
0.000 |
4 |
7 |
|
A |
27 |
7 |
10204 |
◊ |
C |
-x+1,y-1/2,-z+2 |
2_647 |
32 |
9 |
10259 |
249.0 |
1.8 |
0.824 |
3 |
2 |
0 |
0.000 |
8 |
|
D |
29 |
9 |
10240 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
26 |
7 |
10115 |
247.0 |
2.1 |
0.843 |
3 |
2 |
0 |
0.000 |
Average: |
248.0 |
1.9 |
0.833 |
3 |
2 |
0 |
0.000 |
5 |
9 |
|
[GOL]A:149 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
10204 |
136.4 |
-1.2 |
0.501 |
0 |
0 |
0 |
0.019 |
6 |
10 |
|
[GOL]A:148 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
10204 |
119.3 |
-1.2 |
0.448 |
1 |
0 |
0 |
0.025 |
7 |
11 |
|
[GOL]B:147 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
10115 |
117.2 |
-1.3 |
0.428 |
1 |
0 |
0 |
0.027 |
8 |
12 |
|
[SO4]A:147 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
10204 |
109.7 |
-15.7 |
0.707 |
0 |
0 |
0 |
0.248 |
9 |
13 |
|
[SO4]C:148 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
10 |
10259 |
100.1 |
-15.0 |
0.842 |
4 |
0 |
0 |
0.263 |
10 |
14 |
|
[GOL]B:148 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
10115 |
91.7 |
-0.2 |
0.585 |
2 |
0 |
0 |
0.017 |
11 |
15 |
|
D |
13 |
5 |
10240 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
10259 |
88.7 |
-2.2 |
0.222 |
0 |
0 |
0 |
0.000 |
16 |
|
D |
7 |
2 |
10240 |
◊ |
C |
x-1,y,z |
1_455 |
14 |
5 |
10259 |
85.9 |
-2.2 |
0.234 |
0 |
0 |
0 |
0.000 |
Average: |
87.3 |
-2.2 |
0.228 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
[SO4]C:147 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10204 |
72.3 |
-9.6 |
0.822 |
1 |
0 |
0 |
0.158 |
13 |
18 |
|
[SO4]C:146 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10204 |
71.7 |
-9.0 |
0.876 |
2 |
0 |
0 |
0.157 |
14 |
19 |
|
[SO4]D:147 |
5 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10115 |
71.5 |
-9.2 |
0.873 |
3 |
0 |
0 |
0.165 |
15 |
20 |
|
[GOL]B:147 |
5 |
1 |
217 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
10240 |
64.8 |
0.3 |
0.638 |
3 |
0 |
0 |
0.010 |
16 |
21 |
|
[GOL]A:148 |
5 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
10259 |
64.0 |
0.4 |
0.705 |
3 |
0 |
0 |
0.006 |
17 |
22 |
|
[SO4]D:146 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10115 |
63.2 |
-7.9 |
0.790 |
3 |
0 |
0 |
0.144 |
18 |
23 |
|
[SO4]A:146 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
10204 |
62.6 |
-7.8 |
0.824 |
4 |
0 |
0 |
0.151 |
19 |
24 |
|
[SO4]C:147 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
10259 |
56.8 |
-7.0 |
0.862 |
2 |
0 |
0 |
0.053 |
20 |
25 |
|
[NA]B:146 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
10115 |
51.8 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.121 |
21 |
26 |
|
[GOL]B:148 |
4 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
10240 |
45.3 |
0.4 |
0.636 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
[NA]B:146 |
1 |
1 |
125 |
◊ |
C |
x-1,y,z |
1_455 |
11 |
6 |
10259 |
41.9 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.076 |
23 |
28 |
|
[SO4]D:146 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
10240 |
38.9 |
-4.3 |
0.805 |
0 |
0 |
0 |
0.041 |
24 |
29 |
|
[SO4]A:146 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
10259 |
38.8 |
-4.0 |
0.886 |
1 |
0 |
0 |
0.030 |
25 |
30 |
|
[SO4]D:147 |
4 |
1 |
182 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
10240 |
35.8 |
-3.4 |
0.881 |
1 |
0 |
0 |
0.037 |
26 |
31 |
|
[SO4]C:146 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
10259 |
35.3 |
-3.6 |
0.893 |
1 |
0 |
0 |
0.027 |
27 |
32 |
|
[GOL]A:149 |
3 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
10259 |
35.0 |
-0.1 |
0.520 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[GOL]A:149 |
2 |
1 |
220 |
f |
[SO4]A:147 |
x,y,z |
1_555 |
3 |
1 |
185 |
25.1 |
-2.5 |
0.863 |
2 |
0 |
0 |
0.053 |
|