| ## |
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 |
134 |
34 |
12029 |
◊ |
C |
x,y,z |
1_555 |
136 |
35 |
11470 |
1235.4 |
-7.9 |
0.259 |
18 |
11 |
0 |
0.142 |
2 |
|
B |
132 |
34 |
12018 |
◊ |
A |
x,y,z |
1_555 |
130 |
33 |
11609 |
1149.0 |
-6.6 |
0.293 |
13 |
10 |
0 |
0.142 |
| Average: |
1192.2 |
-7.3 |
0.276 |
16 |
11 |
0 |
0.142 |
| 2 |
3 |
|
B |
54 |
19 |
12018 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
66 |
19 |
11609 |
562.8 |
-4.6 |
0.258 |
7 |
3 |
0 |
0.000 |
4 |
|
C |
49 |
15 |
11470 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
49 |
14 |
12029 |
458.5 |
-6.4 |
0.131 |
5 |
0 |
0 |
0.000 |
| Average: |
510.6 |
-5.5 |
0.194 |
6 |
2 |
0 |
0.000 |
| 3 |
5 |
|
A |
66 |
19 |
11609 |
◊ |
D |
-x,y-1/2,-z-1 |
2_544 |
58 |
16 |
12029 |
515.3 |
-4.0 |
0.330 |
2 |
1 |
0 |
0.000 |
| 4 |
6 |
|
B |
61 |
24 |
12018 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
56 |
14 |
11470 |
475.8 |
-1.0 |
0.516 |
4 |
2 |
0 |
0.000 |
| 5 |
7 |
|
C |
35 |
9 |
11470 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
11609 |
275.7 |
-3.9 |
0.175 |
1 |
0 |
0 |
0.000 |
| 6 |
8 |
|
B |
18 |
5 |
12018 |
x |
B |
x-1,y,z |
1_455 |
27 |
9 |
12018 |
198.6 |
-1.2 |
0.362 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
21 |
8 |
12018 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
19 |
7 |
11470 |
170.1 |
-1.4 |
0.390 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
C |
15 |
6 |
11470 |
x |
C |
x-1,y,z |
1_455 |
24 |
6 |
11470 |
169.4 |
-1.7 |
0.248 |
1 |
1 |
0 |
0.000 |
| 9 |
11 |
|
C |
24 |
11 |
11470 |
◊ |
A |
x-1,y,z |
1_455 |
16 |
7 |
11609 |
155.3 |
2.4 |
0.820 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
B |
15 |
7 |
12018 |
◊ |
A |
x-1,y,z |
1_455 |
12 |
4 |
11609 |
116.3 |
0.6 |
0.639 |
0 |
1 |
0 |
0.000 |
| 11 |
13 |
|
[SO4]D:267 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
16 |
9 |
12029 |
105.6 |
-16.2 |
0.766 |
6 |
0 |
0 |
0.153 |
| 12 |
14 |
|
[SO4]C:267 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
16 |
7 |
11470 |
102.3 |
-16.1 |
0.699 |
7 |
0 |
0 |
0.156 |
| 13 |
15 |
|
[SO4]B:267 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
12018 |
102.1 |
-16.2 |
0.686 |
6 |
0 |
0 |
0.161 |
| 14 |
16 |
|
[SO4]A:267 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
11609 |
102.0 |
-15.9 |
0.772 |
8 |
0 |
0 |
0.165 |
| 15 |
17 |
|
[SO4]C:268 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
14 |
4 |
11470 |
97.5 |
-14.2 |
0.818 |
3 |
0 |
0 |
0.126 |
| 16 |
18 |
|
[SO4]B:269 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
12018 |
93.7 |
-13.5 |
0.842 |
3 |
0 |
0 |
0.126 |
| 17 |
19 |
|
[SO4]D:269 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
15 |
4 |
12029 |
92.0 |
-13.4 |
0.777 |
1 |
0 |
0 |
0.112 |
| 18 |
20 |
|
[SO4]A:268 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
11609 |
86.5 |
-11.8 |
0.884 |
4 |
0 |
0 |
0.116 |
| 19 |
21 |
|
[SO4]D:268 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
12029 |
85.1 |
-11.8 |
0.789 |
2 |
0 |
0 |
0.103 |
| 20 |
22 |
|
[SO4]B:268 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
12018 |
72.7 |
-9.8 |
0.782 |
1 |
0 |
0 |
0.087 |
| 21 |
23 |
|
[CO]C:269 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
11470 |
59.8 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.168 |
24 |
|
[CO]D:270 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
12029 |
59.5 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.168 |
25 |
|
[CO]A:269 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
11609 |
59.4 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.168 |
26 |
|
[CO]B:270 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
12018 |
58.8 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.168 |
| Average: |
59.4 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.168 |
| 22 |
27 |
|
A |
7 |
3 |
11609 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
6 |
3 |
12029 |
52.0 |
1.0 |
0.674 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[SO4]B:268 |
4 |
1 |
184 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
11609 |
51.3 |
-5.6 |
0.832 |
1 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[CO]B:270 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
11609 |
35.5 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.049 |
30 |
|
[CO]A:269 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
12018 |
35.2 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.049 |
31 |
|
[CO]C:269 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12029 |
33.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.049 |
32 |
|
[CO]D:270 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
11470 |
30.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.049 |
| Average: |
33.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.049 |
| 25 |
33 |
|
C |
3 |
2 |
11470 |
◊ |
D |
-x,y-1/2,-z-1 |
2_544 |
5 |
2 |
12029 |
24.9 |
0.4 |
0.647 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
B |
5 |
2 |
12018 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
11609 |
23.8 |
-0.0 |
0.581 |
0 |
0 |
0 |
0.000 |
| 27 |
35 |
|
[SO4]B:267 |
3 |
1 |
184 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
11470 |
14.6 |
-1.1 |
0.976 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
B |
3 |
1 |
12018 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
2 |
1 |
12029 |
11.1 |
-0.3 |
0.364 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
D |
1 |
1 |
12029 |
x |
D |
x-1,y,z |
1_455 |
1 |
1 |
12029 |
8.7 |
0.2 |
0.471 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
[SO4]B:269 |
1 |
1 |
184 |
f |
[SO4]B:267 |
x,y,z |
1_555 |
1 |
1 |
184 |
5.3 |
-1.3 |
0.800 |
0 |
0 |
0 |
0.011 |
| 31 |
39 |
|
B |
1 |
1 |
12018 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
1 |
1 |
12029 |
4.9 |
0.4 |
0.851 |
0 |
0 |
0 |
0.000 |
| 32 |
40 |
|
A |
1 |
1 |
11609 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
11609 |
4.8 |
0.2 |
0.805 |
0 |
0 |
0 |
0.000 |
| 33 |
41 |
|
[SO4]B:268 |
1 |
1 |
184 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
2 |
12018 |
4.5 |
-0.6 |
0.693 |
0 |
0 |
0 |
0.000 |
|