| ## |
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 |
113 |
34 |
26243 |
◊ |
A |
x,y,z |
1_555 |
118 |
33 |
26252 |
1154.1 |
-21.6 |
0.002 |
4 |
0 |
0 |
0.212 |
2 |
|
D |
119 |
34 |
26245 |
◊ |
B |
x,y,z |
1_555 |
114 |
34 |
26238 |
1120.6 |
-19.8 |
0.005 |
4 |
1 |
0 |
0.212 |
| Average: |
1137.4 |
-20.7 |
0.003 |
4 |
1 |
0 |
0.212 |
| 2 |
3 |
|
D |
103 |
28 |
26245 |
◊ |
A |
x,y,z |
1_555 |
99 |
28 |
26252 |
895.7 |
-2.0 |
0.615 |
7 |
7 |
0 |
0.048 |
4 |
|
C |
92 |
26 |
26243 |
◊ |
B |
x,y,z |
1_555 |
93 |
26 |
26238 |
836.7 |
-1.9 |
0.607 |
7 |
8 |
0 |
0.048 |
| Average: |
866.2 |
-2.0 |
0.611 |
7 |
8 |
0 |
0.048 |
| 3 |
5 |
|
D |
61 |
15 |
26245 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
65 |
18 |
26238 |
585.8 |
-0.8 |
0.629 |
7 |
7 |
0 |
0.000 |
6 |
|
A |
68 |
18 |
26252 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
58 |
15 |
26243 |
571.2 |
-1.0 |
0.613 |
6 |
7 |
0 |
0.000 |
| Average: |
578.5 |
-0.9 |
0.621 |
7 |
7 |
0 |
0.000 |
| 4 |
7 |
|
C |
45 |
10 |
26243 |
◊ |
D |
x,y,z-1 |
1_554 |
46 |
10 |
26245 |
412.1 |
0.6 |
0.720 |
3 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[UDP]A:901 |
23 |
1 |
530 |
f |
A |
x,y,z |
1_555 |
42 |
14 |
26252 |
313.9 |
-7.1 |
0.557 |
8 |
0 |
0 |
0.183 |
9 |
|
[UDP]C:901 |
24 |
1 |
521 |
f |
C |
x,y,z |
1_555 |
44 |
16 |
26243 |
313.7 |
-6.4 |
0.577 |
7 |
0 |
0 |
0.183 |
10 |
|
[UDP]B:901 |
23 |
1 |
530 |
f |
B |
x,y,z |
1_555 |
43 |
15 |
26238 |
311.2 |
-7.2 |
0.544 |
9 |
0 |
0 |
0.183 |
| Average: |
313.0 |
-6.9 |
0.559 |
8 |
0 |
0 |
0.183 |
| 6 |
11 |
|
[UDP]D:901 |
23 |
1 |
520 |
f |
D |
x,y,z |
1_555 |
43 |
14 |
26245 |
310.2 |
-7.4 |
0.516 |
11 |
0 |
0 |
0.101 |
| 7 |
12 |
|
A |
21 |
6 |
26252 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
31 |
9 |
26238 |
207.2 |
-0.1 |
0.632 |
3 |
0 |
0 |
0.000 |
13 |
|
A |
30 |
8 |
26252 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
19 |
6 |
26238 |
207.0 |
0.0 |
0.641 |
3 |
0 |
0 |
0.000 |
| Average: |
207.1 |
-0.0 |
0.636 |
3 |
0 |
0 |
0.000 |
| 8 |
14 |
|
D |
23 |
9 |
26245 |
◊ |
A |
x-1,y,z |
1_455 |
24 |
10 |
26252 |
179.0 |
-0.6 |
0.555 |
1 |
0 |
0 |
0.000 |
| 9 |
15 |
|
[SO4]D:801 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
26245 |
98.2 |
-13.6 |
0.878 |
6 |
0 |
0 |
0.134 |
| 10 |
16 |
|
[SO4]B:801 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
26238 |
97.1 |
-13.6 |
0.844 |
5 |
0 |
0 |
0.130 |
| 11 |
17 |
|
[SO4]A:801 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
26252 |
95.4 |
-13.9 |
0.868 |
4 |
0 |
0 |
0.142 |
| 12 |
18 |
|
[SO4]C:801 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
26243 |
92.0 |
-13.2 |
0.883 |
4 |
0 |
0 |
0.136 |
| 13 |
19 |
|
[SO4]D:803 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
26245 |
91.0 |
-12.0 |
0.856 |
3 |
0 |
0 |
0.110 |
| 14 |
20 |
|
[SO4]A:803 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
26252 |
90.9 |
-11.5 |
0.857 |
3 |
0 |
0 |
0.117 |
| 15 |
21 |
|
[SO4]C:803 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
14 |
5 |
26243 |
85.9 |
-11.0 |
0.864 |
4 |
0 |
0 |
0.116 |
| 16 |
22 |
|
[SO4]B:803 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
26238 |
84.8 |
-11.0 |
0.850 |
3 |
0 |
0 |
0.101 |
| 17 |
23 |
|
[SO4]D:802 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
26245 |
77.3 |
-9.1 |
0.880 |
1 |
0 |
0 |
0.079 |
| 18 |
24 |
|
[SO4]C:802 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
26243 |
76.9 |
-9.4 |
0.875 |
2 |
0 |
0 |
0.093 |
| 19 |
25 |
|
[SO4]B:802 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
26238 |
67.9 |
-7.8 |
0.875 |
3 |
0 |
0 |
0.075 |
| 20 |
26 |
|
[SO4]D:802 |
3 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
3 |
3 |
26252 |
39.6 |
-4.2 |
0.973 |
1 |
0 |
0 |
0.018 |
| 21 |
27 |
|
[SO4]B:802 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
4 |
4 |
26243 |
36.1 |
-3.9 |
0.952 |
1 |
0 |
0 |
0.017 |
| 22 |
28 |
|
[SO4]C:802 |
3 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
26238 |
33.3 |
-3.4 |
0.964 |
1 |
0 |
0 |
0.015 |
| 23 |
29 |
|
B |
2 |
2 |
26238 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
26252 |
13.5 |
0.7 |
0.890 |
0 |
0 |
0 |
0.000 |
30 |
|
D |
2 |
2 |
26245 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
26243 |
7.7 |
0.4 |
0.825 |
0 |
0 |
0 |
0.000 |
| Average: |
10.6 |
0.6 |
0.858 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
[SO4]D:802 |
2 |
1 |
187 |
◊ |
[SO4]A:801 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.0 |
-1.4 |
0.876 |
0 |
0 |
0 |
0.006 |
| 25 |
32 |
|
[SO4]A:801 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
26245 |
3.7 |
-0.4 |
0.879 |
0 |
0 |
0 |
0.002 |
| 26 |
33 |
|
[SO4]C:801 |
2 |
1 |
185 |
◊ |
[SO4]B:802 |
x,y,z |
1_555 |
1 |
1 |
186 |
2.0 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.002 |
|