## |
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 |
|
B |
155 |
38 |
8387 |
◊ |
A |
x,y,z |
1_555 |
156 |
40 |
8716 |
1346.8 |
-17.5 |
0.263 |
20 |
4 |
0 |
0.166 |
2 |
2 |
|
A |
53 |
17 |
8716 |
x |
A |
-y,x-y-1,z+1/3 |
2_545 |
46 |
12 |
8716 |
446.5 |
-5.9 |
0.292 |
4 |
1 |
0 |
0.000 |
3 |
|
B |
45 |
10 |
8387 |
x |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
49 |
16 |
8387 |
409.6 |
-6.3 |
0.308 |
4 |
1 |
0 |
0.000 |
Average: |
428.0 |
-6.1 |
0.300 |
4 |
1 |
0 |
0.000 |
3 |
4 |
|
A |
27 |
9 |
8716 |
◊ |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
26 |
10 |
8387 |
256.0 |
-2.1 |
0.502 |
2 |
0 |
0 |
0.000 |
5 |
|
A |
25 |
10 |
8716 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
27 |
8 |
8387 |
251.9 |
-2.0 |
0.497 |
2 |
0 |
0 |
0.000 |
Average: |
253.9 |
-2.1 |
0.499 |
2 |
0 |
0 |
0.000 |
4 |
6 |
|
B |
19 |
5 |
8387 |
◊ |
A |
-y-1,x-y-1,z-2/3 |
2_444 |
18 |
5 |
8716 |
161.7 |
-1.4 |
0.533 |
0 |
0 |
0 |
0.000 |
7 |
|
B |
16 |
4 |
8387 |
◊ |
A |
-y,x-y-1,z-2/3 |
2_544 |
12 |
4 |
8716 |
114.3 |
-1.5 |
0.433 |
0 |
0 |
0 |
0.000 |
Average: |
138.0 |
-1.4 |
0.483 |
0 |
0 |
0 |
0.000 |
5 |
8 |
|
[TAM]A:1215 |
10 |
1 |
326 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
8716 |
160.1 |
0.5 |
0.422 |
6 |
0 |
0 |
0.028 |
9 |
|
[TAM]B:1217 |
8 |
1 |
327 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
8387 |
154.3 |
-0.2 |
0.402 |
5 |
0 |
0 |
0.028 |
Average: |
157.2 |
0.1 |
0.412 |
6 |
0 |
0 |
0.028 |
6 |
10 |
|
[Q6T]B:1218 |
12 |
1 |
297 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
8716 |
139.3 |
-2.2 |
0.464 |
0 |
0 |
0 |
0.025 |
11 |
|
[Q6T]A:1216 |
12 |
1 |
297 |
f |
B |
x,y,z |
1_555 |
27 |
9 |
8387 |
139.0 |
-1.9 |
0.543 |
0 |
0 |
0 |
0.025 |
Average: |
139.1 |
-2.0 |
0.503 |
0 |
0 |
0 |
0.025 |
7 |
12 |
|
[Q6T]B:1218 |
12 |
1 |
297 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
8387 |
120.3 |
-1.5 |
0.573 |
1 |
0 |
0 |
0.024 |
13 |
|
[Q6T]A:1216 |
12 |
1 |
297 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
8716 |
119.1 |
-1.6 |
0.538 |
1 |
0 |
0 |
0.024 |
Average: |
119.7 |
-1.5 |
0.556 |
1 |
0 |
0 |
0.024 |
8 |
14 |
|
[EDO]A:1214 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
8716 |
113.2 |
3.7 |
0.525 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
[SO4]A:1211 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
8716 |
102.3 |
-14.6 |
0.812 |
2 |
0 |
0 |
0.095 |
10 |
16 |
|
[EDO]B:1216 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
8387 |
96.9 |
2.6 |
0.512 |
3 |
0 |
0 |
0.000 |
11 |
17 |
|
[SO4]B:1211 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
8387 |
94.3 |
-13.3 |
0.800 |
1 |
0 |
0 |
0.084 |
12 |
18 |
|
[SO4]B:1213 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
8387 |
89.9 |
-13.8 |
0.817 |
5 |
0 |
0 |
0.099 |
13 |
19 |
|
[SO4]A:1212 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8716 |
89.2 |
-13.4 |
0.805 |
4 |
0 |
0 |
0.094 |
14 |
20 |
|
[SO4]B:1214 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
8387 |
88.5 |
-16.9 |
0.735 |
1 |
0 |
0 |
0.106 |
15 |
21 |
|
[EDO]A:1213 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
8716 |
87.1 |
2.9 |
0.518 |
3 |
0 |
0 |
0.000 |
16 |
22 |
|
[SO4]B:1212 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8387 |
83.1 |
-13.3 |
0.632 |
3 |
0 |
0 |
0.090 |
17 |
23 |
|
[SO4]A:1210 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8716 |
79.7 |
-11.1 |
0.885 |
4 |
0 |
0 |
0.079 |
18 |
24 |
|
[SO4]B:1210 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8387 |
78.1 |
-11.3 |
0.901 |
5 |
0 |
0 |
0.083 |
19 |
25 |
|
A |
7 |
3 |
8716 |
◊ |
[TAM]B:1217 |
-y-1,x-y-1,z+1/3 |
2_445 |
8 |
1 |
327 |
64.7 |
2.3 |
0.590 |
1 |
0 |
0 |
0.000 |
26 |
|
[TAM]A:1215 |
6 |
1 |
326 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
7 |
3 |
8387 |
46.6 |
0.9 |
0.478 |
1 |
0 |
0 |
0.000 |
Average: |
55.7 |
1.6 |
0.534 |
1 |
0 |
0 |
0.000 |
20 |
27 |
|
[EDO]A:1213 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
8387 |
47.6 |
1.5 |
0.296 |
1 |
0 |
0 |
0.000 |
21 |
28 |
|
[SO4]B:1214 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
8716 |
30.8 |
-3.3 |
0.954 |
1 |
0 |
0 |
0.023 |
22 |
29 |
|
A |
3 |
1 |
8716 |
◊ |
[SO4]B:1212 |
-y-1,x-y-1,z+1/3 |
2_445 |
4 |
1 |
187 |
30.0 |
-2.7 |
0.960 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[EDO]A:1214 |
2 |
1 |
183 |
f |
[SO4]A:1211 |
x,y,z |
1_555 |
2 |
1 |
186 |
25.1 |
-2.7 |
0.980 |
0 |
0 |
0 |
0.016 |
24 |
31 |
|
[SO4]A:1212 |
1 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
8387 |
16.5 |
-2.2 |
0.728 |
0 |
0 |
0 |
0.013 |
25 |
32 |
|
B |
2 |
1 |
8387 |
f |
[EDO]B:1216 |
-y-1,x-y-1,z+1/3 |
2_445 |
1 |
1 |
183 |
14.1 |
0.0 |
0.631 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
[SO4]A:1210 |
2 |
1 |
185 |
◊ |
A |
-y,x-y-1,z+1/3 |
2_545 |
3 |
2 |
8716 |
11.8 |
-1.6 |
0.706 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[SO4]B:1213 |
1 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8716 |
5.1 |
-0.7 |
0.642 |
0 |
0 |
0 |
0.004 |
28 |
35 |
|
[EDO]A:1213 |
2 |
1 |
183 |
f |
[SO4]B:1214 |
x,y,z |
1_555 |
1 |
1 |
187 |
4.3 |
-0.4 |
0.894 |
0 |
0 |
0 |
0.003 |
29 |
36 |
|
B |
1 |
1 |
8387 |
◊ |
[SO4]B:1210 |
-y-1,x-y-1,z+1/3 |
2_445 |
1 |
1 |
184 |
4.0 |
-0.6 |
0.635 |
0 |
0 |
0 |
0.000 |
|