| ## |
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 |
253 |
43 |
5406 |
◊ |
B |
x,y,z |
1_555 |
359 |
89 |
11361 |
3001.0 |
-31.0 |
0.467 |
62 |
5 |
0 |
0.582 |
2 |
|
C |
245 |
43 |
5459 |
◊ |
A |
x,y,z |
1_555 |
348 |
88 |
11117 |
2961.6 |
-33.6 |
0.412 |
57 |
5 |
0 |
0.582 |
| Average: |
2981.3 |
-32.3 |
0.440 |
60 |
5 |
0 |
0.582 |
| 2 |
3 |
|
A |
85 |
22 |
11117 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
85 |
22 |
11117 |
730.4 |
4.6 |
0.955 |
12 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
71 |
21 |
11361 |
◊ |
B |
x,-y,-z |
3_555 |
71 |
21 |
11361 |
648.0 |
4.5 |
0.919 |
10 |
2 |
0 |
0.000 |
| 4 |
5 |
|
A |
56 |
18 |
11117 |
◊ |
B |
x-1/2,y-1/2,z |
5_445 |
59 |
19 |
11361 |
589.8 |
-7.1 |
0.246 |
2 |
0 |
0 |
0.000 |
6 |
|
B |
55 |
18 |
11361 |
◊ |
A |
x,y,z |
1_555 |
60 |
18 |
11117 |
543.6 |
-6.3 |
0.285 |
2 |
0 |
0 |
0.000 |
| Average: |
566.7 |
-6.7 |
0.265 |
2 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
25 |
9 |
5406 |
◊ |
D |
x,-y,-z |
3_555 |
25 |
9 |
5406 |
298.3 |
-0.8 |
0.795 |
2 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[1V3]A:1201 |
18 |
1 |
428 |
f |
A |
x,y,z |
1_555 |
50 |
16 |
11117 |
290.8 |
-10.1 |
0.410 |
2 |
0 |
0 |
0.092 |
| 7 |
9 |
|
C |
21 |
8 |
5459 |
◊ |
C |
-x,y,-z+1/2 |
4_555 |
21 |
8 |
5459 |
160.2 |
3.8 |
0.973 |
4 |
0 |
0 |
0.000 |
| 8 |
10 |
|
D |
15 |
7 |
5406 |
◊ |
B |
x,-y,-z |
3_555 |
17 |
6 |
11361 |
151.0 |
-1.9 |
0.386 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
C |
13 |
6 |
5459 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
15 |
4 |
11117 |
132.7 |
-2.3 |
0.313 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[SO4]B:1202 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
11361 |
112.3 |
-18.2 |
0.669 |
7 |
0 |
0 |
0.210 |
| 11 |
13 |
|
[SO4]A:1203 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11117 |
99.5 |
-15.1 |
0.872 |
6 |
0 |
0 |
0.149 |
| 12 |
14 |
|
C |
5 |
3 |
5459 |
◊ |
B |
x-1/2,y-1/2,z |
5_445 |
8 |
5 |
11361 |
79.6 |
-1.1 |
0.367 |
0 |
0 |
0 |
0.000 |
15 |
|
D |
5 |
3 |
5406 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
11117 |
71.1 |
-1.0 |
0.421 |
0 |
0 |
0 |
0.000 |
| Average: |
75.4 |
-1.0 |
0.394 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
A |
8 |
2 |
11117 |
◊ |
A |
x,-y-1,-z |
3_545 |
8 |
2 |
11117 |
75.9 |
1.0 |
0.822 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[GOL]C:1201 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
17 |
6 |
5459 |
75.8 |
-0.2 |
0.605 |
3 |
0 |
0 |
0.013 |
| 15 |
18 |
|
[GOL]C:1201 |
6 |
1 |
221 |
◊ |
C |
-x,y,-z+1/2 |
4_555 |
15 |
6 |
5459 |
73.0 |
0.0 |
0.620 |
2 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[SO4]B:1203 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
11361 |
72.5 |
-8.3 |
0.908 |
3 |
0 |
0 |
0.095 |
| 17 |
20 |
|
[SO4]A:1204 |
5 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
11117 |
72.0 |
-8.6 |
0.912 |
3 |
0 |
0 |
0.084 |
| 18 |
21 |
|
[SO4]A:1204 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
5459 |
70.0 |
-10.2 |
0.781 |
1 |
0 |
0 |
0.089 |
| 19 |
22 |
|
[SO4]B:1203 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
13 |
4 |
5406 |
66.6 |
-9.7 |
0.786 |
1 |
0 |
0 |
0.100 |
| 20 |
23 |
|
[GOL]C:1201 |
4 |
1 |
221 |
◊ |
[GOL]C:1201 |
-x,y,-z+1/2 |
4_555 |
4 |
1 |
221 |
64.1 |
-0.7 |
0.345 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
C |
3 |
1 |
5459 |
◊ |
B |
-x,y,-z+1/2 |
4_555 |
8 |
3 |
11361 |
60.3 |
-1.3 |
0.226 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
B |
7 |
1 |
11361 |
◊ |
B |
-x,y,-z+1/2 |
4_555 |
7 |
1 |
11361 |
59.3 |
0.3 |
0.720 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
A |
6 |
2 |
11117 |
◊ |
D |
x-1/2,-y-1/2,-z |
7_445 |
3 |
1 |
5406 |
56.6 |
-1.7 |
0.170 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[1V3]A:1201 |
3 |
1 |
428 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
5459 |
49.7 |
-4.9 |
0.329 |
0 |
0 |
0 |
0.041 |
| 25 |
28 |
|
C |
2 |
1 |
5459 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
11361 |
45.5 |
-0.6 |
0.297 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
6 |
2 |
11117 |
◊ |
D |
x-1/2,y-1/2,z |
5_445 |
2 |
1 |
5406 |
39.8 |
-0.4 |
0.351 |
0 |
0 |
0 |
0.000 |
| Average: |
42.7 |
-0.5 |
0.324 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
A |
4 |
2 |
11117 |
◊ |
B |
x-1/2,-y-1/2,-z |
7_445 |
7 |
2 |
11361 |
38.9 |
0.1 |
0.666 |
1 |
1 |
0 |
0.000 |
| 27 |
31 |
|
[SO4]A:1203 |
2 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
4 |
3 |
5459 |
30.7 |
-3.6 |
0.851 |
0 |
0 |
0 |
0.030 |
| 28 |
32 |
|
B |
2 |
1 |
11361 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
3 |
1 |
11117 |
29.3 |
0.6 |
0.846 |
1 |
1 |
0 |
0.000 |
| 29 |
33 |
|
[SO4]A:1203 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
11361 |
13.4 |
-1.3 |
0.832 |
0 |
0 |
0 |
0.000 |
| 30 |
34 |
|
[SO4]B:1202 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
5406 |
12.8 |
-1.4 |
0.774 |
0 |
0 |
0 |
0.014 |
| 31 |
35 |
|
A |
1 |
1 |
11117 |
◊ |
[SO4]B:1202 |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
185 |
7.4 |
-0.8 |
0.799 |
0 |
0 |
0 |
0.000 |
|