| ## |
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 |
|
E |
121 |
30 |
13590 |
◊ |
C |
x,y,z |
1_555 |
120 |
27 |
12409 |
1106.4 |
-15.9 |
0.126 |
6 |
0 |
0 |
0.258 |
| 2 |
2 |
|
F |
118 |
28 |
12280 |
◊ |
A |
x,y,z |
1_555 |
110 |
32 |
13672 |
1016.5 |
-13.8 |
0.118 |
6 |
0 |
0 |
0.225 |
| 3 |
3 |
|
D |
87 |
22 |
12096 |
◊ |
B |
x,y,z |
1_555 |
85 |
22 |
12098 |
797.9 |
-13.1 |
0.078 |
4 |
0 |
0 |
0.216 |
| 4 |
4 |
|
B |
76 |
25 |
12098 |
◊ |
B |
-y,-x,-z+1/4 |
8_555 |
76 |
25 |
12098 |
727.3 |
-2.4 |
0.659 |
9 |
2 |
0 |
0.000 |
| 5 |
5 |
|
C |
76 |
22 |
12409 |
◊ |
A |
x,y,z |
1_555 |
73 |
18 |
13672 |
627.8 |
-1.1 |
0.610 |
9 |
8 |
0 |
0.024 |
| 6 |
6 |
|
F |
68 |
19 |
12280 |
◊ |
E |
x,y,z |
1_555 |
68 |
19 |
13590 |
549.5 |
-1.4 |
0.641 |
11 |
8 |
0 |
0.067 |
7 |
|
B |
44 |
13 |
12098 |
◊ |
A |
x,y,z |
1_555 |
41 |
15 |
13672 |
362.6 |
-2.3 |
0.487 |
2 |
4 |
0 |
0.067 |
| Average: |
456.1 |
-1.9 |
0.564 |
7 |
6 |
0 |
0.067 |
| 7 |
8 |
|
C |
55 |
15 |
12409 |
◊ |
B |
x,y,z |
1_555 |
57 |
20 |
12098 |
505.1 |
-2.3 |
0.545 |
4 |
5 |
0 |
0.063 |
9 |
|
F |
56 |
16 |
12280 |
◊ |
D |
x,y,z |
1_555 |
59 |
21 |
12096 |
503.5 |
-3.8 |
0.424 |
5 |
7 |
0 |
0.063 |
| Average: |
504.3 |
-3.1 |
0.485 |
5 |
6 |
0 |
0.063 |
| 8 |
10 |
|
E |
46 |
20 |
13590 |
◊ |
D |
x,y,z |
1_555 |
57 |
17 |
12096 |
471.3 |
-3.6 |
0.464 |
3 |
4 |
0 |
0.049 |
| 9 |
11 |
|
B |
37 |
10 |
12098 |
◊ |
A |
-x,y,-z |
5_555 |
45 |
16 |
13672 |
421.9 |
0.2 |
0.498 |
6 |
3 |
0 |
0.000 |
| 10 |
12 |
|
E |
47 |
16 |
13590 |
◊ |
E |
-y,-x,-z+1/4 |
8_555 |
46 |
15 |
13590 |
363.3 |
-0.0 |
0.841 |
6 |
6 |
0 |
0.000 |
| 11 |
13 |
|
E |
28 |
6 |
13590 |
◊ |
B |
x,y,z |
1_555 |
30 |
8 |
12098 |
264.9 |
-2.8 |
0.410 |
0 |
1 |
0 |
0.011 |
| 12 |
14 |
|
F |
33 |
11 |
12280 |
◊ |
C |
x,y-1,z |
1_545 |
33 |
14 |
12409 |
259.2 |
2.4 |
0.871 |
3 |
0 |
0 |
0.000 |
| 13 |
15 |
|
F |
30 |
8 |
12280 |
◊ |
C |
x,y,z |
1_555 |
29 |
7 |
12409 |
239.2 |
-2.8 |
0.343 |
0 |
2 |
0 |
0.012 |
| 14 |
16 |
|
D |
26 |
7 |
12096 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
13672 |
230.1 |
-2.5 |
0.391 |
1 |
3 |
0 |
0.013 |
| 15 |
17 |
|
E |
30 |
8 |
13590 |
◊ |
E |
-x+1,y,-z |
5_655 |
30 |
8 |
13590 |
223.6 |
-4.8 |
0.223 |
2 |
0 |
0 |
0.002 |
| 16 |
18 |
|
F |
18 |
7 |
12280 |
◊ |
B |
x,y-1,z |
1_545 |
30 |
10 |
12098 |
210.1 |
-0.8 |
0.322 |
3 |
0 |
0 |
0.000 |
| 17 |
19 |
|
C |
21 |
7 |
12409 |
◊ |
C |
-x+1,y,-z |
5_655 |
21 |
7 |
12409 |
200.0 |
3.6 |
0.942 |
6 |
0 |
0 |
0.000 |
| 18 |
20 |
|
D |
19 |
6 |
12096 |
◊ |
C |
-y,-x,-z+1/4 |
8_555 |
20 |
5 |
12409 |
159.5 |
-1.6 |
0.416 |
1 |
1 |
0 |
0.000 |
| 19 |
21 |
|
E |
14 |
4 |
13590 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
13672 |
139.7 |
-2.2 |
0.221 |
0 |
0 |
0 |
0.008 |
| 20 |
22 |
|
E |
17 |
5 |
13590 |
◊ |
A |
-x+1,y,-z |
5_655 |
14 |
4 |
13672 |
131.8 |
-2.0 |
0.316 |
0 |
0 |
0 |
0.001 |
| 21 |
23 |
|
E |
15 |
6 |
13590 |
◊ |
C |
x,y-1,z |
1_545 |
15 |
5 |
12409 |
120.7 |
-1.1 |
0.446 |
0 |
2 |
0 |
0.000 |
| 22 |
24 |
|
B |
12 |
5 |
12098 |
◊ |
B |
-x,y,-z |
5_555 |
12 |
5 |
12098 |
115.7 |
-0.0 |
0.662 |
0 |
2 |
0 |
0.000 |
| 23 |
25 |
|
[PO4]D:301 |
5 |
1 |
189 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
12096 |
107.0 |
-7.7 |
0.659 |
6 |
0 |
0 |
0.151 |
| 24 |
26 |
|
[PO4]B:301 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
12098 |
104.5 |
-7.5 |
0.696 |
8 |
0 |
0 |
0.160 |
| 25 |
27 |
|
[PO4]F:301 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
12280 |
104.0 |
-7.5 |
0.649 |
9 |
0 |
0 |
0.157 |
| 26 |
28 |
|
[PO4]E:301 |
5 |
1 |
189 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
13590 |
102.9 |
-7.2 |
0.736 |
7 |
0 |
0 |
0.143 |
| 27 |
29 |
|
[PO4]A:301 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
13672 |
102.8 |
-7.5 |
0.716 |
8 |
0 |
0 |
0.151 |
| 28 |
30 |
|
[PO4]C:301 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
12409 |
101.6 |
-7.2 |
0.703 |
7 |
0 |
0 |
0.142 |
| 29 |
31 |
|
[SO4]A:302 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
13672 |
101.2 |
-15.9 |
0.706 |
3 |
0 |
0 |
0.236 |
| 30 |
32 |
|
[SO4]B:302 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
12098 |
99.1 |
-15.5 |
0.708 |
3 |
0 |
0 |
0.245 |
| 31 |
33 |
|
[SO4]E:302 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
18 |
9 |
13590 |
96.5 |
-15.1 |
0.793 |
2 |
0 |
0 |
0.222 |
| 32 |
34 |
|
[SO4]C:302 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
12409 |
95.6 |
-15.1 |
0.738 |
4 |
0 |
0 |
0.234 |
| 33 |
35 |
|
[SO4]F:302 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
16 |
7 |
12280 |
94.9 |
-15.4 |
0.682 |
3 |
0 |
0 |
0.230 |
| 34 |
36 |
|
[SO4]D:302 |
5 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
16 |
7 |
12096 |
91.6 |
-14.3 |
0.765 |
3 |
0 |
0 |
0.228 |
| 35 |
37 |
|
C |
15 |
9 |
12409 |
◊ |
A |
-x+1,y,-z |
5_655 |
14 |
6 |
13672 |
90.2 |
-0.4 |
0.511 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
D |
8 |
4 |
12096 |
◊ |
A |
-y,x-1,z+1/4 |
3_545 |
13 |
6 |
13672 |
78.9 |
-1.0 |
0.399 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
F |
11 |
5 |
12280 |
◊ |
A |
x,y-1,z |
1_545 |
13 |
4 |
13672 |
66.4 |
0.6 |
0.726 |
1 |
0 |
0 |
0.000 |
| 38 |
40 |
|
D |
6 |
2 |
12096 |
◊ |
B |
x,y-1,z |
1_545 |
7 |
3 |
12098 |
57.7 |
0.6 |
0.774 |
1 |
1 |
0 |
0.000 |
| 39 |
41 |
|
[CA]D:303 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
12096 |
25.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.073 |
42 |
|
[CA]A:303 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
12098 |
23.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.073 |
43 |
|
[CA]D:303 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
13590 |
23.4 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
24.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.073 |
| 40 |
44 |
|
F |
3 |
2 |
12280 |
◊ |
E |
-x+1,y,-z |
5_655 |
6 |
3 |
13590 |
24.7 |
0.2 |
0.711 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[CA]A:303 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
12409 |
24.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.042 |
46 |
|
[CA]A:303 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
13672 |
23.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.042 |
47 |
|
[CA]D:303 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
4 |
2 |
12280 |
23.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.042 |
| Average: |
23.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.042 |
|