## |
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 |
127 |
36 |
18849 |
◊ |
A |
x,y,z-1 |
1_554 |
128 |
35 |
18471 |
1092.0 |
-9.6 |
0.217 |
14 |
2 |
0 |
0.401 |
2 |
|
D |
127 |
36 |
18447 |
◊ |
C |
x,y,z-1 |
1_554 |
124 |
35 |
18603 |
1080.4 |
-9.1 |
0.267 |
15 |
2 |
0 |
0.401 |
Average: |
1086.2 |
-9.4 |
0.242 |
15 |
2 |
0 |
0.401 |
2 |
3 |
|
B |
41 |
13 |
18849 |
◊ |
A |
x,y,z |
1_555 |
37 |
11 |
18471 |
326.4 |
-0.7 |
0.579 |
2 |
0 |
0 |
0.000 |
4 |
|
D |
34 |
11 |
18447 |
◊ |
C |
x,y,z |
1_555 |
36 |
12 |
18603 |
317.9 |
0.5 |
0.711 |
2 |
2 |
0 |
0.000 |
Average: |
322.2 |
-0.1 |
0.645 |
2 |
1 |
0 |
0.000 |
3 |
5 |
|
C |
30 |
9 |
18603 |
◊ |
D |
x-1,y,z |
1_455 |
33 |
10 |
18447 |
284.5 |
0.9 |
0.730 |
4 |
2 |
0 |
0.000 |
4 |
6 |
|
D |
38 |
10 |
18447 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
27 |
9 |
18849 |
283.0 |
-3.6 |
0.236 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
[H79]D:502 |
24 |
1 |
582 |
f |
D |
x,y,z |
1_555 |
48 |
16 |
18447 |
275.8 |
-5.6 |
0.272 |
5 |
0 |
0 |
0.195 |
6 |
8 |
|
[H79]B:504 |
21 |
1 |
600 |
f |
B |
x,y,z |
1_555 |
48 |
18 |
18849 |
274.4 |
-5.9 |
0.294 |
5 |
0 |
0 |
0.110 |
7 |
9 |
|
[H79]C:503 |
21 |
1 |
598 |
f |
C |
x,y,z |
1_555 |
49 |
18 |
18603 |
272.5 |
-5.3 |
0.349 |
6 |
0 |
0 |
0.199 |
8 |
10 |
|
[H79]A:504 |
21 |
1 |
594 |
f |
A |
x,y,z |
1_555 |
45 |
16 |
18471 |
264.6 |
-4.9 |
0.369 |
6 |
0 |
0 |
0.102 |
9 |
11 |
|
C |
25 |
8 |
18603 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
25 |
10 |
18849 |
190.4 |
-1.4 |
0.446 |
0 |
2 |
0 |
0.000 |
10 |
12 |
|
B |
20 |
8 |
18849 |
x |
B |
x-1,y,z |
1_455 |
18 |
5 |
18849 |
151.0 |
0.9 |
0.708 |
2 |
0 |
0 |
0.000 |
11 |
13 |
|
C |
15 |
5 |
18603 |
◊ |
B |
x-1,y,z |
1_455 |
19 |
8 |
18849 |
148.5 |
0.4 |
0.583 |
2 |
0 |
0 |
0.000 |
12 |
14 |
|
[IMD]B:503 |
5 |
1 |
197 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
18849 |
122.4 |
4.2 |
0.401 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[IMD]D:501 |
5 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
21 |
11 |
18447 |
121.9 |
4.2 |
0.411 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
[IMD]C:502 |
5 |
1 |
197 |
f |
C |
x,y,z |
1_555 |
21 |
11 |
18603 |
121.5 |
4.2 |
0.420 |
1 |
0 |
0 |
0.000 |
15 |
17 |
|
[IMD]A:503 |
5 |
1 |
197 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
18471 |
121.5 |
4.3 |
0.488 |
1 |
0 |
0 |
0.000 |
16 |
18 |
|
A |
17 |
4 |
18471 |
◊ |
B |
x-1,y,z+1 |
1_456 |
12 |
4 |
18849 |
120.3 |
1.1 |
0.782 |
1 |
1 |
0 |
0.000 |
17 |
19 |
|
D |
17 |
8 |
18447 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
17 |
8 |
18471 |
97.8 |
-0.1 |
0.520 |
0 |
0 |
0 |
0.000 |
18 |
20 |
|
[SO4]B:502 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
18849 |
94.4 |
-13.5 |
0.869 |
4 |
0 |
0 |
0.205 |
19 |
21 |
|
[SO4]A:501 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
18471 |
92.4 |
-12.8 |
0.873 |
4 |
0 |
0 |
0.195 |
20 |
22 |
|
[H79]D:502 |
8 |
1 |
582 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
12 |
4 |
18471 |
91.2 |
-1.8 |
0.547 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
C |
10 |
4 |
18603 |
◊ |
B |
x,y,z |
1_555 |
16 |
6 |
18849 |
90.0 |
-2.1 |
0.217 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
[SO4]C:501 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
18603 |
89.0 |
-12.9 |
0.893 |
4 |
0 |
0 |
0.368 |
23 |
25 |
|
A |
10 |
4 |
18471 |
x |
A |
x-1,y,z |
1_455 |
13 |
4 |
18471 |
85.6 |
-0.2 |
0.505 |
0 |
1 |
0 |
0.000 |
24 |
26 |
|
D |
10 |
7 |
18447 |
◊ |
B |
x,y,z-1 |
1_554 |
15 |
7 |
18849 |
84.2 |
0.0 |
0.617 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
C |
12 |
6 |
18603 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
4 |
18471 |
73.7 |
-0.6 |
0.508 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
[SO4]B:501 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
18849 |
63.2 |
-8.3 |
0.822 |
1 |
0 |
0 |
0.118 |
27 |
29 |
|
[SO4]A:502 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
18471 |
57.1 |
-7.3 |
0.857 |
1 |
0 |
0 |
0.105 |
28 |
30 |
|
A |
5 |
2 |
18471 |
◊ |
[SO4]A:502 |
x-1,y,z |
1_455 |
5 |
1 |
185 |
53.9 |
-5.7 |
0.871 |
1 |
0 |
0 |
0.000 |
29 |
31 |
|
D |
4 |
2 |
18447 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
18849 |
45.2 |
0.4 |
0.747 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
D |
3 |
2 |
18447 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
2 |
2 |
18471 |
17.3 |
-0.0 |
0.507 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[H79]A:504 |
2 |
1 |
594 |
f |
[SO4]A:501 |
x,y,z |
1_555 |
2 |
1 |
187 |
14.5 |
-1.9 |
0.790 |
0 |
0 |
0 |
0.026 |
32 |
34 |
|
[H79]B:504 |
2 |
1 |
600 |
f |
[SO4]B:502 |
x,y,z |
1_555 |
1 |
1 |
186 |
12.5 |
-1.8 |
0.732 |
0 |
0 |
0 |
0.024 |
33 |
35 |
|
D |
2 |
1 |
18447 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
18471 |
8.4 |
0.2 |
0.424 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[H79]C:503 |
1 |
1 |
598 |
f |
[SO4]C:501 |
x,y,z |
1_555 |
2 |
1 |
187 |
7.7 |
-1.0 |
0.815 |
0 |
0 |
0 |
0.026 |
35 |
37 |
|
D |
1 |
1 |
18447 |
◊ |
[SO4]B:501 |
-x,y-1/2,-z |
2_545 |
1 |
1 |
186 |
3.8 |
-0.5 |
0.582 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
D |
1 |
1 |
18447 |
◊ |
C |
x-1,y,z-1 |
1_454 |
1 |
1 |
18603 |
2.2 |
-0.0 |
0.546 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
D |
1 |
1 |
18447 |
x |
D |
x-1,y,z |
1_455 |
1 |
1 |
18447 |
1.6 |
0.1 |
0.756 |
0 |
0 |
0 |
0.000 |
|