## |
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 |
376 |
94 |
14705 |
◊ |
A |
x,y,z |
1_555 |
385 |
99 |
15119 |
3732.1 |
-57.9 |
0.016 |
41 |
6 |
0 |
0.767 |
2 |
|
D |
368 |
97 |
13674 |
◊ |
C |
x,y,z |
1_555 |
365 |
93 |
14326 |
3698.3 |
-59.5 |
0.017 |
38 |
5 |
0 |
0.767 |
Average: |
3715.2 |
-58.7 |
0.017 |
40 |
6 |
0 |
0.767 |
2 |
3 |
|
A |
88 |
21 |
15119 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
96 |
25 |
14705 |
851.2 |
-6.8 |
0.548 |
16 |
6 |
0 |
0.276 |
3 |
4 |
|
A |
53 |
15 |
15119 |
◊ |
D |
x,y,z-1 |
1_554 |
44 |
10 |
13674 |
461.0 |
-2.5 |
0.673 |
7 |
2 |
0 |
0.000 |
5 |
|
D |
25 |
10 |
13674 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
17 |
2 |
15119 |
188.3 |
-3.6 |
0.244 |
1 |
0 |
0 |
0.000 |
Average: |
324.6 |
-3.0 |
0.459 |
4 |
1 |
0 |
0.000 |
4 |
6 |
|
C |
50 |
14 |
14326 |
◊ |
A |
x,y,z |
1_555 |
47 |
16 |
15119 |
425.2 |
-2.1 |
0.642 |
4 |
1 |
0 |
0.000 |
7 |
|
D |
47 |
12 |
13674 |
◊ |
B |
x,y,z |
1_555 |
48 |
14 |
14705 |
415.0 |
-1.8 |
0.692 |
4 |
0 |
0 |
0.000 |
Average: |
420.1 |
-1.9 |
0.667 |
4 |
1 |
0 |
0.000 |
5 |
8 |
|
D |
49 |
18 |
13674 |
◊ |
A |
x,y,z |
1_555 |
49 |
18 |
15119 |
420.2 |
-0.1 |
0.844 |
3 |
1 |
0 |
0.000 |
6 |
9 |
|
A |
29 |
8 |
15119 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
26 |
8 |
15119 |
264.9 |
0.9 |
0.778 |
4 |
3 |
0 |
0.000 |
7 |
10 |
|
C |
36 |
16 |
14326 |
◊ |
B |
x,y,z |
1_555 |
29 |
12 |
14705 |
263.1 |
3.2 |
0.913 |
3 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
32 |
6 |
15119 |
◊ |
C |
x,y,z-1 |
1_554 |
24 |
5 |
14326 |
262.3 |
1.5 |
0.857 |
4 |
2 |
0 |
0.000 |
12 |
|
D |
7 |
2 |
13674 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
5 |
1 |
14705 |
56.5 |
0.8 |
0.819 |
0 |
0 |
0 |
0.000 |
Average: |
159.4 |
1.2 |
0.838 |
2 |
1 |
0 |
0.000 |
9 |
13 |
|
B |
26 |
4 |
14705 |
◊ |
C |
x,y,z-1 |
1_554 |
28 |
12 |
14326 |
253.1 |
-1.9 |
0.502 |
3 |
0 |
0 |
0.000 |
14 |
|
C |
19 |
4 |
14326 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
28 |
12 |
14705 |
213.4 |
-2.7 |
0.377 |
2 |
0 |
0 |
0.000 |
Average: |
233.3 |
-2.3 |
0.440 |
3 |
0 |
0 |
0.000 |
10 |
15 |
|
B |
28 |
6 |
14705 |
◊ |
D |
x,y,z-1 |
1_554 |
25 |
6 |
13674 |
222.0 |
-1.8 |
0.585 |
4 |
0 |
0 |
0.000 |
16 |
|
C |
23 |
6 |
14326 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
24 |
6 |
15119 |
205.2 |
-1.3 |
0.580 |
4 |
0 |
0 |
0.000 |
Average: |
213.6 |
-1.5 |
0.582 |
4 |
0 |
0 |
0.000 |
11 |
17 |
|
[MPD]B:302 |
7 |
1 |
268 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
14705 |
150.2 |
-9.7 |
0.637 |
2 |
0 |
0 |
0.197 |
12 |
18 |
|
[ACT]A:301 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
15119 |
88.2 |
-1.4 |
0.523 |
0 |
0 |
0 |
0.011 |
13 |
19 |
|
[PO4]B:301 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
14705 |
87.8 |
-5.2 |
0.834 |
1 |
0 |
0 |
0.106 |
14 |
20 |
|
[PO4]C:301 |
5 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
14326 |
86.6 |
-5.3 |
0.832 |
1 |
0 |
0 |
0.058 |
15 |
21 |
|
[MPD]B:302 |
5 |
1 |
268 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
15119 |
80.4 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.041 |
16 |
22 |
|
[ACT]A:301 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
14705 |
63.3 |
-1.4 |
0.427 |
0 |
0 |
0 |
0.026 |
17 |
23 |
|
[MG]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
13674 |
53.3 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.160 |
24 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
14705 |
49.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.160 |
25 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
14326 |
49.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.160 |
Average: |
50.8 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.160 |
18 |
26 |
|
[CA]A:302 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
15119 |
45.6 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.221 |
19 |
27 |
|
B |
6 |
2 |
14705 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
4 |
15119 |
41.9 |
-0.3 |
0.510 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[MPD]B:302 |
1 |
1 |
268 |
f |
[PO4]B:301 |
x,y,z |
1_555 |
4 |
1 |
189 |
14.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.022 |
21 |
29 |
|
C |
2 |
1 |
14326 |
◊ |
B |
-x+1/2,y-1/2,-z+2 |
4_547 |
3 |
3 |
14705 |
14.0 |
0.6 |
0.850 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
[PO4]C:301 |
1 |
1 |
189 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
13674 |
11.5 |
-0.8 |
0.431 |
0 |
0 |
0 |
0.008 |
23 |
31 |
|
[PO4]B:301 |
1 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15119 |
10.2 |
-0.7 |
0.442 |
0 |
0 |
0 |
0.006 |
24 |
32 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[PO4]B:301 |
x,y,z |
1_555 |
1 |
1 |
189 |
5.9 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.017 |
25 |
33 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
[PO4]C:301 |
x,y,z |
1_555 |
1 |
1 |
189 |
4.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.007 |
|