## |
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 |
139 |
40 |
13100 |
◊ |
A |
x,y,z |
1_555 |
123 |
34 |
12344 |
1250.8 |
-18.2 |
0.116 |
14 |
1 |
0 |
0.498 |
2 |
|
F |
129 |
39 |
12858 |
◊ |
D |
x,y,z |
1_555 |
115 |
33 |
12542 |
1176.0 |
-16.0 |
0.183 |
13 |
1 |
0 |
0.498 |
3 |
|
B |
107 |
31 |
12481 |
◊ |
A |
x,y,z |
1_555 |
129 |
38 |
12344 |
1141.1 |
-12.8 |
0.298 |
14 |
3 |
0 |
0.498 |
4 |
|
C |
97 |
24 |
13100 |
◊ |
B |
x,y,z |
1_555 |
123 |
36 |
12481 |
1054.4 |
-12.3 |
0.281 |
15 |
5 |
0 |
0.498 |
5 |
|
E |
96 |
24 |
12608 |
◊ |
D |
x,y,z |
1_555 |
121 |
35 |
12542 |
1032.0 |
-12.7 |
0.238 |
15 |
2 |
0 |
0.498 |
6 |
|
F |
101 |
25 |
12858 |
◊ |
E |
x,y,z |
1_555 |
118 |
34 |
12608 |
1025.8 |
-11.8 |
0.361 |
15 |
6 |
0 |
0.498 |
Average: |
1113.3 |
-14.0 |
0.246 |
14 |
3 |
0 |
0.498 |
2 |
7 |
|
E |
59 |
19 |
12608 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
50 |
15 |
13100 |
543.4 |
-6.1 |
0.290 |
4 |
8 |
0 |
0.000 |
8 |
|
B |
59 |
18 |
12481 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
50 |
15 |
12858 |
541.5 |
-7.6 |
0.193 |
3 |
6 |
0 |
0.000 |
Average: |
542.4 |
-6.9 |
0.242 |
4 |
7 |
0 |
0.000 |
3 |
9 |
|
C |
44 |
12 |
13100 |
x |
C |
-x+1,y-1/2,-z+1 |
2_646 |
33 |
10 |
13100 |
322.2 |
-2.4 |
0.537 |
2 |
0 |
0 |
0.000 |
4 |
10 |
|
D |
21 |
6 |
12542 |
x |
D |
-x,y-1/2,-z+2 |
2_547 |
25 |
10 |
12542 |
224.9 |
0.1 |
0.687 |
3 |
0 |
0 |
0.000 |
11 |
|
A |
21 |
7 |
12344 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
25 |
12 |
12344 |
219.9 |
-0.8 |
0.562 |
2 |
0 |
0 |
0.000 |
Average: |
222.4 |
-0.3 |
0.625 |
3 |
0 |
0 |
0.000 |
5 |
12 |
|
F |
28 |
9 |
12858 |
x |
F |
-x+1,y-1/2,-z+2 |
2_647 |
27 |
7 |
12858 |
210.8 |
-0.8 |
0.606 |
0 |
0 |
0 |
0.000 |
6 |
13 |
|
E |
21 |
7 |
12608 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
19 |
6 |
12344 |
191.0 |
-1.3 |
0.568 |
0 |
0 |
0 |
0.000 |
7 |
14 |
|
[ADE]B:301 |
10 |
1 |
270 |
f |
B |
x,y,z |
1_555 |
28 |
15 |
12481 |
186.1 |
4.0 |
0.511 |
2 |
0 |
0 |
0.000 |
15 |
|
[ADE]E:301 |
10 |
1 |
270 |
f |
E |
x,y,z |
1_555 |
30 |
12 |
12608 |
181.0 |
4.1 |
0.536 |
3 |
0 |
0 |
0.000 |
16 |
|
[ADE]A:301 |
10 |
1 |
272 |
f |
A |
x,y,z |
1_555 |
29 |
14 |
12344 |
174.8 |
3.8 |
0.468 |
2 |
0 |
0 |
0.000 |
17 |
|
[ADE]D:301 |
10 |
1 |
271 |
f |
D |
x,y,z |
1_555 |
28 |
14 |
12542 |
171.0 |
4.1 |
0.548 |
3 |
0 |
0 |
0.000 |
Average: |
178.2 |
4.0 |
0.516 |
3 |
0 |
0 |
0.000 |
8 |
18 |
|
[SO4]C:301 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
17 |
10 |
13100 |
106.7 |
-19.9 |
0.600 |
7 |
0 |
0 |
0.180 |
9 |
19 |
|
[SO4]F:301 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
17 |
10 |
12858 |
106.2 |
-20.0 |
0.605 |
7 |
0 |
0 |
0.184 |
10 |
20 |
|
[SO4]B:302 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
12481 |
105.9 |
-19.9 |
0.606 |
7 |
0 |
0 |
0.180 |
11 |
21 |
|
[SO4]E:302 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
12608 |
105.4 |
-19.9 |
0.616 |
7 |
0 |
0 |
0.183 |
12 |
22 |
|
[SO4]D:302 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
16 |
8 |
12542 |
104.4 |
-20.0 |
0.598 |
7 |
0 |
0 |
0.184 |
13 |
23 |
|
[SO4]A:302 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
12344 |
104.1 |
-19.8 |
0.601 |
7 |
0 |
0 |
0.179 |
14 |
24 |
|
B |
11 |
4 |
12481 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
12 |
4 |
12542 |
99.5 |
-1.0 |
0.508 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
B |
10 |
3 |
12481 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
4 |
13100 |
97.4 |
-1.4 |
0.355 |
0 |
0 |
0 |
0.000 |
16 |
26 |
|
E |
6 |
1 |
12608 |
◊ |
F |
-x+1,y-1/2,-z+2 |
2_647 |
7 |
2 |
12858 |
65.9 |
-0.7 |
0.317 |
0 |
0 |
0 |
0.000 |
17 |
27 |
|
A |
3 |
2 |
12344 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
3 |
13100 |
17.8 |
0.1 |
0.680 |
0 |
0 |
0 |
0.000 |
18 |
28 |
|
E |
3 |
1 |
12608 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13100 |
12.4 |
-0.1 |
0.377 |
0 |
0 |
0 |
0.000 |
19 |
29 |
|
E |
1 |
1 |
12608 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
12344 |
10.8 |
0.0 |
0.677 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
[SO4]A:302 |
2 |
1 |
184 |
f |
[ADE]A:301 |
x,y,z |
1_555 |
1 |
1 |
272 |
5.6 |
-0.7 |
0.980 |
0 |
0 |
0 |
0.005 |
21 |
31 |
|
[SO4]D:302 |
2 |
1 |
184 |
f |
[ADE]D:301 |
x,y,z |
1_555 |
1 |
1 |
271 |
3.3 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.003 |
22 |
32 |
|
[SO4]E:302 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
12542 |
3.2 |
-0.4 |
0.871 |
0 |
0 |
0 |
0.003 |
23 |
33 |
|
B |
1 |
1 |
12481 |
◊ |
F |
x,y,z-1 |
1_554 |
1 |
1 |
12858 |
3.1 |
-0.0 |
0.539 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
[SO4]B:302 |
1 |
1 |
186 |
f |
[ADE]B:301 |
x,y,z |
1_555 |
1 |
1 |
270 |
2.9 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.003 |
25 |
35 |
|
[SO4]B:302 |
1 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12344 |
2.6 |
-0.3 |
0.861 |
0 |
0 |
0 |
0.002 |
26 |
36 |
|
[SO4]E:302 |
2 |
1 |
185 |
f |
[ADE]E:301 |
x,y,z |
1_555 |
1 |
1 |
270 |
2.3 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.002 |
27 |
37 |
|
A |
1 |
1 |
12344 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
13100 |
2.3 |
0.0 |
0.579 |
0 |
0 |
0 |
0.000 |
|