| ## |
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 |
521 |
126 |
17588 |
◊ |
A |
x,y,z |
1_555 |
506 |
125 |
17486 |
4763.5 |
-65.3 |
0.002 |
49 |
1 |
0 |
0.772 |
2 |
|
D |
512 |
124 |
17617 |
◊ |
C |
x,y,z |
1_555 |
514 |
124 |
17410 |
4739.8 |
-65.3 |
0.002 |
47 |
2 |
0 |
0.772 |
| Average: |
4751.6 |
-65.3 |
0.002 |
48 |
2 |
0 |
0.772 |
| 2 |
3 |
|
A |
38 |
11 |
17486 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
42 |
11 |
17410 |
327.9 |
-3.6 |
0.353 |
0 |
0 |
0 |
0.000 |
4 |
|
B |
40 |
12 |
17588 |
◊ |
B |
-x,y,-z |
2_555 |
40 |
12 |
17588 |
321.1 |
-3.6 |
0.360 |
0 |
0 |
0 |
0.000 |
| Average: |
324.5 |
-3.6 |
0.357 |
0 |
0 |
0 |
0.000 |
| 3 |
5 |
|
B |
29 |
7 |
17588 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
33 |
8 |
17410 |
296.3 |
-1.5 |
0.538 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
32 |
8 |
17588 |
◊ |
B |
-x,y,-z+1 |
2_556 |
32 |
8 |
17588 |
263.3 |
-4.0 |
0.247 |
2 |
0 |
0 |
0.029 |
7 |
|
C |
28 |
8 |
17410 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
17486 |
255.4 |
-3.9 |
0.215 |
2 |
0 |
0 |
0.029 |
| Average: |
259.4 |
-3.9 |
0.231 |
2 |
0 |
0 |
0.029 |
| 5 |
8 |
|
[PLP]A:1404 |
15 |
1 |
379 |
cf |
A |
x,y,z |
1_555 |
35 |
15 |
17486 |
226.8 |
1.5 |
0.639 |
3 |
0 |
0 |
0.004 |
9 |
|
[PLP]B:1404 |
15 |
1 |
383 |
cf |
B |
x,y,z |
1_555 |
39 |
15 |
17588 |
225.8 |
1.9 |
0.655 |
3 |
0 |
0 |
0.004 |
10 |
|
[PLP]D:1404 |
15 |
1 |
386 |
cf |
D |
x,y,z |
1_555 |
37 |
15 |
17617 |
223.3 |
1.9 |
0.653 |
3 |
0 |
0 |
0.004 |
11 |
|
[PLP]C:1404 |
15 |
1 |
385 |
cf |
C |
x,y,z |
1_555 |
40 |
15 |
17410 |
221.9 |
1.4 |
0.603 |
4 |
0 |
0 |
0.004 |
| Average: |
224.4 |
1.7 |
0.638 |
3 |
0 |
0 |
0.004 |
| 6 |
12 |
|
B |
24 |
6 |
17588 |
◊ |
A |
-x,y,-z+1 |
2_556 |
23 |
10 |
17486 |
223.4 |
0.6 |
0.694 |
0 |
2 |
0 |
0.005 |
13 |
|
C |
22 |
8 |
17410 |
◊ |
B |
x,y,z |
1_555 |
22 |
11 |
17588 |
208.6 |
-0.4 |
0.626 |
0 |
0 |
0 |
0.005 |
14 |
|
D |
15 |
9 |
17617 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
17486 |
167.4 |
-0.2 |
0.631 |
2 |
0 |
0 |
0.005 |
| Average: |
199.8 |
-0.0 |
0.650 |
1 |
1 |
0 |
0.005 |
| 7 |
15 |
|
D |
23 |
10 |
17617 |
◊ |
A |
-x,y,-z+1 |
2_556 |
22 |
11 |
17486 |
190.5 |
-3.2 |
0.239 |
0 |
0 |
0 |
0.013 |
| 8 |
16 |
|
A |
12 |
4 |
17486 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
11 |
3 |
17617 |
116.2 |
1.2 |
0.806 |
2 |
0 |
0 |
0.000 |
17 |
|
B |
15 |
4 |
17588 |
◊ |
A |
-x,y,-z |
2_555 |
11 |
3 |
17486 |
108.7 |
1.6 |
0.779 |
1 |
0 |
0 |
0.000 |
18 |
|
B |
9 |
3 |
17588 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
14 |
4 |
17410 |
104.7 |
1.0 |
0.785 |
2 |
0 |
0 |
0.000 |
| Average: |
109.9 |
1.2 |
0.790 |
2 |
0 |
0 |
0.000 |
| 9 |
19 |
|
D |
12 |
4 |
17617 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
17588 |
97.2 |
0.2 |
0.695 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
10 |
4 |
17486 |
◊ |
A |
-x,y,-z+1 |
2_556 |
10 |
4 |
17486 |
77.7 |
-0.0 |
0.654 |
0 |
0 |
0 |
0.000 |
| Average: |
87.4 |
0.1 |
0.674 |
0 |
0 |
0 |
0.000 |
| 10 |
21 |
|
[PLP]B:1404 |
6 |
1 |
383 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
17486 |
78.3 |
-2.6 |
0.332 |
2 |
0 |
0 |
0.063 |
22 |
|
[PLP]A:1404 |
6 |
1 |
379 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
17588 |
76.0 |
-2.6 |
0.353 |
2 |
0 |
0 |
0.063 |
23 |
|
[PLP]C:1404 |
6 |
1 |
385 |
◊ |
D |
x,y,z |
1_555 |
13 |
5 |
17617 |
73.9 |
-2.5 |
0.349 |
2 |
0 |
0 |
0.063 |
24 |
|
[PLP]D:1404 |
6 |
1 |
386 |
◊ |
C |
x,y,z |
1_555 |
12 |
5 |
17410 |
73.6 |
-2.7 |
0.350 |
2 |
0 |
0 |
0.063 |
| Average: |
75.5 |
-2.6 |
0.346 |
2 |
0 |
0 |
0.063 |
| 11 |
25 |
|
[NA]A:1405 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
17486 |
62.7 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.172 |
26 |
|
[NA]C:1405 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
17410 |
62.5 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.172 |
27 |
|
[NA]B:1405 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
17588 |
62.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.172 |
28 |
|
[NA]D:1405 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
17617 |
61.4 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.172 |
| Average: |
62.2 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.172 |
| 12 |
29 |
|
[MG]A:1999 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
7 |
4 |
17486 |
30.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.036 |
30 |
|
[MG]B:1999 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
7 |
4 |
17588 |
30.2 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.036 |
31 |
|
[MG]A:1999 |
1 |
1 |
98 |
x |
C |
x,y,z |
1_555 |
7 |
4 |
17410 |
27.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.036 |
| Average: |
29.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.036 |
| 13 |
32 |
|
[MG]A:1999 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
3 |
1 |
17588 |
14.0 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.014 |
33 |
|
[MG]B:1999 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
3 |
1 |
17486 |
12.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.014 |
34 |
|
[MG]A:1999 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
3 |
1 |
17617 |
11.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.014 |
| Average: |
12.8 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.014 |
|