## |
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 |
184 |
48 |
14157 |
◊ |
A |
x,y,z |
1_555 |
188 |
48 |
14066 |
1705.8 |
-18.0 |
0.176 |
18 |
3 |
0 |
0.879 |
2 |
|
E |
168 |
47 |
14075 |
◊ |
C |
x,y,z |
1_555 |
169 |
45 |
14046 |
1586.1 |
-15.0 |
0.222 |
17 |
8 |
0 |
0.879 |
3 |
|
F |
160 |
39 |
11845 |
◊ |
B |
x,y,z |
1_555 |
166 |
43 |
14042 |
1574.1 |
-13.6 |
0.298 |
20 |
8 |
0 |
0.879 |
Average: |
1622.0 |
-15.5 |
0.232 |
18 |
6 |
0 |
0.879 |
2 |
4 |
|
D |
168 |
42 |
14157 |
◊ |
C |
x,y,z |
1_555 |
166 |
43 |
14046 |
1547.0 |
-17.0 |
0.138 |
18 |
0 |
0 |
0.860 |
5 |
|
E |
167 |
44 |
14075 |
◊ |
B |
x,y,z |
1_555 |
173 |
44 |
14042 |
1544.2 |
-17.2 |
0.134 |
18 |
0 |
0 |
0.860 |
6 |
|
F |
112 |
33 |
11845 |
◊ |
A |
x,y,z |
1_555 |
114 |
25 |
14066 |
1068.2 |
-15.3 |
0.064 |
10 |
0 |
0 |
0.860 |
Average: |
1386.5 |
-16.5 |
0.112 |
15 |
0 |
0 |
0.860 |
3 |
7 |
|
B |
115 |
26 |
14042 |
◊ |
A |
x,y,z |
1_555 |
141 |
38 |
14066 |
1185.3 |
-9.5 |
0.347 |
20 |
9 |
0 |
0.685 |
8 |
|
C |
135 |
39 |
14046 |
◊ |
A |
x,y,z |
1_555 |
119 |
27 |
14066 |
1176.2 |
-10.0 |
0.317 |
19 |
9 |
0 |
0.685 |
9 |
|
F |
116 |
26 |
11845 |
◊ |
E |
x,y,z |
1_555 |
134 |
37 |
14075 |
1165.6 |
-9.8 |
0.306 |
20 |
9 |
0 |
0.685 |
10 |
|
C |
112 |
26 |
14046 |
◊ |
B |
x,y,z |
1_555 |
131 |
39 |
14042 |
1133.6 |
-9.5 |
0.330 |
20 |
9 |
0 |
0.685 |
11 |
|
F |
134 |
37 |
11845 |
◊ |
D |
x,y,z |
1_555 |
110 |
26 |
14157 |
1133.5 |
-9.7 |
0.336 |
18 |
9 |
0 |
0.685 |
12 |
|
E |
113 |
25 |
14075 |
◊ |
D |
x,y,z |
1_555 |
135 |
38 |
14157 |
1125.0 |
-9.5 |
0.328 |
20 |
9 |
0 |
0.685 |
Average: |
1153.2 |
-9.7 |
0.327 |
20 |
9 |
0 |
0.685 |
4 |
13 |
|
A |
42 |
13 |
14066 |
◊ |
E |
-x+3/2,-y,z-1/2 |
2_654 |
39 |
10 |
14075 |
371.3 |
2.2 |
0.845 |
8 |
3 |
0 |
0.000 |
5 |
14 |
|
A |
33 |
11 |
14066 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
10 |
14075 |
298.1 |
1.0 |
0.782 |
6 |
6 |
0 |
0.000 |
6 |
15 |
|
D |
25 |
6 |
14157 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
32 |
10 |
14042 |
240.9 |
1.8 |
0.777 |
5 |
3 |
0 |
0.000 |
7 |
16 |
|
F |
24 |
8 |
11845 |
◊ |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
23 |
6 |
14042 |
231.2 |
0.2 |
0.709 |
3 |
2 |
0 |
0.000 |
8 |
17 |
|
E |
24 |
6 |
14075 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
17 |
4 |
14046 |
188.0 |
1.5 |
0.796 |
4 |
7 |
0 |
0.000 |
9 |
18 |
|
D |
24 |
8 |
14157 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
15 |
3 |
14042 |
165.1 |
0.1 |
0.574 |
0 |
2 |
0 |
0.000 |
10 |
19 |
|
F |
11 |
5 |
11845 |
◊ |
B |
x-1,y,z |
1_455 |
13 |
4 |
14042 |
118.0 |
-1.6 |
0.360 |
0 |
0 |
0 |
0.000 |
11 |
20 |
|
D |
12 |
4 |
14157 |
◊ |
F |
-x+1/2,-y,z-1/2 |
2_554 |
13 |
5 |
11845 |
116.7 |
-1.4 |
0.405 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
A |
16 |
3 |
14066 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
13 |
4 |
14157 |
112.5 |
-0.9 |
0.516 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
[BCT]F:287 |
4 |
1 |
163 |
f |
F |
x,y,z |
1_555 |
18 |
10 |
11845 |
95.3 |
0.8 |
0.593 |
6 |
0 |
0 |
0.061 |
14 |
23 |
|
[BCT]D:286 |
4 |
1 |
161 |
f |
D |
x,y,z |
1_555 |
18 |
10 |
14157 |
94.0 |
0.9 |
0.780 |
6 |
0 |
0 |
0.100 |
24 |
|
[BCT]E:286 |
4 |
1 |
162 |
f |
E |
x,y,z |
1_555 |
18 |
10 |
14075 |
93.6 |
0.9 |
0.766 |
6 |
0 |
0 |
0.100 |
Average: |
93.8 |
0.9 |
0.773 |
6 |
0 |
0 |
0.100 |
15 |
25 |
|
[BCT]B:286 |
4 |
1 |
163 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
14042 |
94.0 |
0.8 |
0.772 |
6 |
0 |
0 |
0.100 |
26 |
|
[BCT]A:287 |
4 |
1 |
162 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
14066 |
92.7 |
0.8 |
0.764 |
6 |
0 |
0 |
0.100 |
Average: |
93.3 |
0.8 |
0.768 |
6 |
0 |
0 |
0.100 |
16 |
27 |
|
[BCT]C:286 |
4 |
1 |
162 |
f |
C |
x,y,z |
1_555 |
18 |
10 |
14046 |
93.5 |
0.8 |
0.771 |
7 |
0 |
0 |
0.100 |
17 |
28 |
|
E |
13 |
4 |
14075 |
x |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
7 |
3 |
14075 |
81.8 |
0.4 |
0.724 |
1 |
2 |
0 |
0.000 |
18 |
29 |
|
[BCT]F:288 |
4 |
1 |
163 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
11845 |
78.1 |
0.9 |
0.669 |
1 |
0 |
0 |
0.000 |
19 |
30 |
|
E |
10 |
3 |
14075 |
◊ |
C |
x-1,y,z |
1_455 |
10 |
5 |
14046 |
76.5 |
-1.2 |
0.377 |
0 |
0 |
0 |
0.000 |
20 |
31 |
|
D |
9 |
5 |
14157 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
6 |
14066 |
70.4 |
-0.6 |
0.515 |
0 |
0 |
0 |
0.000 |
21 |
32 |
|
A |
6 |
2 |
14066 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
9 |
4 |
14042 |
56.1 |
0.1 |
0.674 |
1 |
0 |
0 |
0.000 |
22 |
33 |
|
[SO4]A:286 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
14042 |
54.3 |
-7.3 |
0.779 |
1 |
0 |
0 |
0.212 |
23 |
34 |
|
[SO4]F:286 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
11845 |
54.1 |
-7.2 |
0.797 |
1 |
0 |
0 |
0.248 |
24 |
35 |
|
[SO4]A:286 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
14046 |
52.5 |
-7.3 |
0.776 |
1 |
0 |
0 |
0.088 |
25 |
36 |
|
[SO4]A:286 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
14066 |
51.7 |
-6.9 |
0.776 |
0 |
0 |
0 |
0.079 |
26 |
37 |
|
[SO4]F:286 |
5 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
14157 |
51.6 |
-6.8 |
0.784 |
1 |
0 |
0 |
0.084 |
27 |
38 |
|
[SO4]F:286 |
5 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
11 |
5 |
14075 |
50.9 |
-6.7 |
0.779 |
1 |
0 |
0 |
0.084 |
28 |
39 |
|
A |
9 |
5 |
14066 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
14046 |
31.1 |
1.2 |
0.798 |
0 |
0 |
0 |
0.000 |
29 |
40 |
|
A |
2 |
1 |
14066 |
◊ |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
2 |
1 |
14042 |
12.2 |
0.1 |
0.540 |
0 |
0 |
0 |
0.000 |
|