## |
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 |
296 |
68 |
16638 |
◊ |
C |
x,y,z |
1_555 |
292 |
68 |
16498 |
2793.8 |
-47.8 |
0.002 |
18 |
7 |
0 |
0.606 |
2 |
|
B |
292 |
68 |
16679 |
◊ |
A |
x,y,z |
1_555 |
294 |
69 |
16897 |
2787.0 |
-47.6 |
0.003 |
19 |
7 |
0 |
0.606 |
Average: |
2790.4 |
-47.7 |
0.002 |
19 |
7 |
0 |
0.606 |
2 |
3 |
|
D |
171 |
44 |
16638 |
◊ |
A |
x,y,z |
1_555 |
163 |
42 |
16897 |
1628.2 |
-4.8 |
0.663 |
28 |
5 |
0 |
0.326 |
4 |
|
C |
157 |
42 |
16498 |
◊ |
B |
x,y,z |
1_555 |
153 |
42 |
16679 |
1540.5 |
-6.6 |
0.598 |
22 |
4 |
0 |
0.326 |
Average: |
1584.4 |
-5.7 |
0.630 |
25 |
5 |
0 |
0.326 |
3 |
5 |
|
D |
96 |
28 |
16638 |
◊ |
B |
x,y,z |
1_555 |
94 |
28 |
16679 |
896.1 |
-11.7 |
0.142 |
8 |
0 |
0 |
0.324 |
6 |
|
C |
93 |
28 |
16498 |
◊ |
A |
x,y,z |
1_555 |
92 |
28 |
16897 |
894.5 |
-11.6 |
0.135 |
8 |
0 |
0 |
0.324 |
Average: |
895.3 |
-11.7 |
0.138 |
8 |
0 |
0 |
0.324 |
4 |
7 |
|
[NAI]C:801 |
44 |
1 |
878 |
f |
C |
x,y,z |
1_555 |
87 |
33 |
16498 |
624.7 |
-5.4 |
0.593 |
9 |
0 |
0 |
0.498 |
8 |
|
[NAI]B:801 |
42 |
1 |
869 |
f |
B |
x,y,z |
1_555 |
93 |
33 |
16679 |
621.5 |
-6.0 |
0.567 |
14 |
0 |
0 |
0.498 |
9 |
|
[NAI]D:801 |
42 |
1 |
867 |
f |
D |
x,y,z |
1_555 |
86 |
35 |
16638 |
617.8 |
-6.4 |
0.476 |
11 |
0 |
0 |
0.498 |
10 |
|
[NAI]A:801 |
43 |
1 |
859 |
f |
A |
x,y,z |
1_555 |
79 |
33 |
16897 |
597.9 |
-5.5 |
0.543 |
14 |
0 |
0 |
0.498 |
Average: |
615.5 |
-5.8 |
0.545 |
12 |
0 |
0 |
0.498 |
5 |
11 |
|
B |
42 |
14 |
16679 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
36 |
12 |
16897 |
382.1 |
-1.5 |
0.582 |
2 |
0 |
0 |
0.000 |
6 |
12 |
|
[49C]D:802 |
23 |
1 |
516 |
f |
D |
x,y,z |
1_555 |
47 |
19 |
16638 |
339.2 |
-4.8 |
0.382 |
5 |
0 |
0 |
0.150 |
7 |
13 |
|
B |
33 |
11 |
16679 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
37 |
13 |
16897 |
313.1 |
3.3 |
0.899 |
4 |
2 |
0 |
0.000 |
8 |
14 |
|
B |
30 |
10 |
16679 |
◊ |
A |
x,y-1,z |
1_545 |
31 |
12 |
16897 |
266.4 |
2.1 |
0.844 |
1 |
2 |
0 |
0.000 |
9 |
15 |
|
D |
24 |
9 |
16638 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
31 |
13 |
16897 |
235.7 |
1.7 |
0.760 |
2 |
0 |
0 |
0.000 |
10 |
16 |
|
B |
22 |
8 |
16679 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
25 |
7 |
16638 |
230.2 |
-1.4 |
0.510 |
2 |
0 |
0 |
0.000 |
11 |
17 |
|
C |
38 |
11 |
16498 |
x |
C |
-x,y-1/2,-z+1 |
2_546 |
25 |
8 |
16498 |
217.6 |
1.8 |
0.836 |
2 |
0 |
0 |
0.000 |
12 |
18 |
|
D |
18 |
9 |
16638 |
x |
D |
-x,y-1/2,-z |
2_545 |
19 |
8 |
16638 |
173.9 |
0.4 |
0.714 |
3 |
3 |
0 |
0.000 |
13 |
19 |
|
B |
14 |
6 |
16679 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
6 |
16498 |
119.0 |
0.9 |
0.765 |
1 |
1 |
0 |
0.000 |
14 |
20 |
|
C |
12 |
5 |
16498 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
16 |
4 |
16897 |
108.7 |
1.5 |
0.829 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[49C]D:802 |
14 |
1 |
516 |
f |
[NAI]D:801 |
x,y,z |
1_555 |
12 |
1 |
867 |
104.8 |
-1.3 |
0.529 |
0 |
0 |
0 |
0.028 |
16 |
22 |
|
B |
8 |
4 |
16679 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
16679 |
98.5 |
0.6 |
0.754 |
2 |
0 |
0 |
0.000 |
17 |
23 |
|
[SO4]A:802 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
16897 |
95.4 |
-12.2 |
0.851 |
2 |
0 |
0 |
0.210 |
18 |
24 |
|
[SO4]C:802 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
16498 |
92.7 |
-12.0 |
0.858 |
3 |
0 |
0 |
0.257 |
19 |
25 |
|
D |
8 |
3 |
16638 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
3 |
16679 |
82.1 |
0.1 |
0.671 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
[SO4]A:802 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
16498 |
52.3 |
-7.7 |
0.548 |
1 |
0 |
0 |
0.101 |
21 |
27 |
|
[SO4]C:802 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
16897 |
51.2 |
-6.8 |
0.837 |
1 |
0 |
0 |
0.090 |
22 |
28 |
|
A |
3 |
1 |
16897 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
3 |
1 |
16638 |
30.1 |
0.1 |
0.568 |
0 |
0 |
0 |
0.000 |
23 |
29 |
|
D |
3 |
1 |
16638 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
16897 |
18.9 |
0.3 |
0.757 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[NAI]C:801 |
3 |
1 |
878 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
16498 |
11.1 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
25 |
31 |
|
[SO4]C:802 |
1 |
1 |
187 |
◊ |
[SO4]A:802 |
x,y,z |
1_555 |
1 |
1 |
187 |
10.5 |
-2.5 |
0.800 |
0 |
0 |
0 |
0.031 |
26 |
32 |
|
C |
3 |
2 |
16498 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
2 |
16897 |
5.8 |
0.0 |
0.652 |
0 |
0 |
0 |
0.000 |
27 |
33 |
|
[SO4]C:802 |
1 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
16638 |
3.5 |
-0.5 |
0.723 |
0 |
0 |
0 |
0.005 |
|