## |
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 |
72 |
22 |
11192 |
◊ |
A |
x,y,z |
1_555 |
74 |
23 |
11015 |
698.2 |
-7.8 |
0.148 |
8 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
68 |
17 |
11015 |
◊ |
B |
-y+1,x,z |
3_655 |
65 |
18 |
11192 |
595.1 |
-4.5 |
0.316 |
0 |
1 |
0 |
0.000 |
3 |
3 |
|
B |
45 |
14 |
11192 |
x |
B |
-y+1,x,z |
3_655 |
42 |
16 |
11192 |
458.2 |
-5.2 |
0.165 |
4 |
2 |
0 |
0.000 |
4 |
|
A |
42 |
16 |
11015 |
x |
A |
-y+1,x,z |
3_655 |
42 |
13 |
11015 |
411.2 |
-5.2 |
0.170 |
6 |
2 |
0 |
0.000 |
Average: |
434.7 |
-5.2 |
0.168 |
5 |
2 |
0 |
0.000 |
4 |
5 |
|
A |
32 |
11 |
11015 |
◊ |
A |
y,x,-z |
7_555 |
33 |
11 |
11015 |
355.8 |
-0.5 |
0.567 |
4 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
30 |
7 |
11192 |
◊ |
A |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
33 |
11 |
11015 |
294.2 |
-1.9 |
0.384 |
2 |
1 |
0 |
0.000 |
6 |
7 |
|
[3PO]A:1000 |
13 |
1 |
326 |
f |
A |
x,y,z |
1_555 |
40 |
19 |
11015 |
221.9 |
-5.2 |
0.665 |
14 |
0 |
0 |
0.074 |
7 |
8 |
|
[3PO]B:1000 |
13 |
1 |
327 |
f |
B |
x,y,z |
1_555 |
38 |
17 |
11192 |
221.2 |
-5.6 |
0.685 |
14 |
0 |
0 |
0.072 |
8 |
9 |
|
A |
16 |
6 |
11015 |
◊ |
A |
-x+1,y,-z |
5_655 |
17 |
6 |
11015 |
130.3 |
2.4 |
0.863 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]B:1101 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
11192 |
113.1 |
3.6 |
0.468 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]A:1101 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
11015 |
108.9 |
3.1 |
0.422 |
4 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]A:1102 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
10 |
11015 |
107.5 |
4.0 |
0.631 |
5 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:1106 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
11015 |
99.5 |
3.4 |
0.482 |
2 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]B:1100 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11192 |
94.4 |
2.2 |
0.247 |
3 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:1104 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
11015 |
93.2 |
2.6 |
0.421 |
2 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:1100 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
11015 |
92.1 |
2.9 |
0.490 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
B |
8 |
2 |
11192 |
◊ |
B |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
8 |
2 |
11192 |
92.0 |
-1.4 |
0.242 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:1105 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
11015 |
91.2 |
2.1 |
0.379 |
2 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]A:1103 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
11015 |
87.9 |
1.8 |
0.238 |
2 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]B:1104 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
11015 |
77.2 |
1.6 |
0.213 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]B:1102 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
11192 |
71.6 |
1.9 |
0.282 |
2 |
0 |
0 |
0.000 |
21 |
22 |
|
[EDO]B:1103 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
11192 |
66.8 |
1.6 |
0.660 |
2 |
0 |
0 |
0.000 |
22 |
23 |
|
[EDO]B:1102 |
4 |
1 |
184 |
◊ |
A |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
12 |
5 |
11015 |
62.3 |
2.2 |
0.305 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
A |
8 |
3 |
11015 |
◊ |
[EDO]A:1104 |
-y+1,x,z |
3_655 |
4 |
1 |
184 |
48.7 |
1.2 |
0.733 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[EDO]B:1104 |
3 |
1 |
186 |
f |
B |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
3 |
2 |
11192 |
44.7 |
1.7 |
0.963 |
3 |
0 |
0 |
0.000 |
25 |
26 |
|
[EDO]A:1106 |
3 |
1 |
185 |
◊ |
[EDO]A:1100 |
x,y,z |
1_555 |
4 |
1 |
184 |
38.6 |
1.4 |
1.000 |
1 |
0 |
0 |
0.000 |
26 |
27 |
|
[EDO]B:1102 |
2 |
1 |
184 |
f |
B |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
7 |
2 |
11192 |
38.1 |
0.2 |
0.531 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[MG]B:500 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
11192 |
37.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
29 |
|
[MG]A:500 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11015 |
37.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
37.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
28 |
30 |
|
[3PO]A:1000 |
3 |
1 |
326 |
f |
[MG]A:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.034 |
31 |
|
[3PO]B:1000 |
3 |
1 |
327 |
f |
[MG]B:500 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
34.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.034 |
29 |
32 |
|
[EDO]A:1100 |
2 |
1 |
184 |
f |
B |
-y+1,x,z |
3_655 |
5 |
2 |
11192 |
23.2 |
0.2 |
0.586 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
[EDO]A:1103 |
3 |
1 |
185 |
f |
B |
-y+1,x,z |
3_655 |
2 |
1 |
11192 |
16.9 |
-0.0 |
0.470 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
[EDO]A:1106 |
2 |
1 |
185 |
◊ |
B |
-y+1,x,z |
3_655 |
3 |
1 |
11192 |
8.8 |
0.3 |
0.822 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[EDO]A:1105 |
1 |
1 |
186 |
f |
A |
y,x,-z |
7_555 |
1 |
1 |
11015 |
2.7 |
0.1 |
0.857 |
0 |
0 |
0 |
0.000 |
33 |
36 |
|
[EDO]A:1104 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11192 |
1.8 |
0.1 |
0.846 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
A |
1 |
1 |
11015 |
◊ |
A |
-y+1/2,-x+1/2,-z+1/2 |
16_555 |
1 |
1 |
11015 |
1.0 |
-0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
|