## |
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 |
502 |
121 |
18235 |
◊ |
A |
x,y,z |
1_555 |
494 |
119 |
18214 |
4693.1 |
-72.7 |
0.007 |
53 |
6 |
0 |
1.000 |
2 |
2 |
|
B |
49 |
16 |
18235 |
◊ |
A |
x-1,y,z |
1_455 |
50 |
15 |
18214 |
405.4 |
0.5 |
0.863 |
0 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
35 |
15 |
18214 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
37 |
14 |
18235 |
320.3 |
-1.4 |
0.692 |
3 |
2 |
0 |
0.000 |
4 |
4 |
|
A |
32 |
12 |
18214 |
◊ |
B |
x,y-1,z |
1_545 |
24 |
8 |
18235 |
235.1 |
2.5 |
0.935 |
1 |
0 |
0 |
0.000 |
5 |
5 |
|
[3VR]A:502 |
15 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
42 |
12 |
18214 |
227.6 |
-5.3 |
0.601 |
2 |
0 |
0 |
0.130 |
6 |
|
[3VR]B:502 |
15 |
1 |
400 |
f |
B |
x,y,z |
1_555 |
40 |
12 |
18235 |
227.2 |
-5.3 |
0.583 |
2 |
0 |
0 |
0.130 |
Average: |
227.4 |
-5.3 |
0.592 |
2 |
0 |
0 |
0.130 |
6 |
7 |
|
[EPE]A:503 |
14 |
1 |
404 |
f |
A |
x,y,z |
1_555 |
28 |
13 |
18214 |
216.9 |
5.5 |
0.107 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
[EPE]B:503 |
14 |
1 |
402 |
f |
B |
x,y,z |
1_555 |
28 |
13 |
18235 |
214.0 |
5.4 |
0.091 |
4 |
0 |
0 |
0.000 |
8 |
9 |
|
[PLP]A:501 |
15 |
1 |
384 |
cf |
A |
x,y,z |
1_555 |
37 |
16 |
18214 |
210.5 |
1.5 |
0.732 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
[PLP]B:501 |
15 |
1 |
382 |
cf |
B |
x,y,z |
1_555 |
38 |
16 |
18235 |
208.6 |
1.5 |
0.723 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
A |
16 |
6 |
18214 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
26 |
8 |
18214 |
168.4 |
0.6 |
0.685 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
B |
12 |
6 |
18235 |
x |
B |
x-1,y,z |
1_455 |
12 |
4 |
18235 |
104.2 |
-2.3 |
0.250 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]B:505 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
18235 |
103.1 |
3.4 |
0.535 |
3 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]A:504 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
18214 |
102.1 |
3.3 |
0.532 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:507 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
9 |
18214 |
99.6 |
2.7 |
0.515 |
4 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:505 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
18214 |
93.4 |
1.6 |
0.368 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:509 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
18214 |
85.7 |
2.5 |
0.306 |
3 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:506 |
4 |
1 |
184 |
f |
B |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
7 |
18235 |
83.1 |
3.1 |
0.336 |
2 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]A:508 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
18214 |
80.6 |
1.8 |
0.250 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]B:504 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
18235 |
79.6 |
2.4 |
0.307 |
1 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]B:504 |
4 |
1 |
185 |
f |
A |
x-1,y,z |
1_455 |
16 |
5 |
18214 |
77.0 |
0.9 |
0.672 |
2 |
0 |
0 |
0.000 |
21 |
22 |
|
A |
8 |
2 |
18214 |
x |
A |
x-1,y,z |
1_455 |
8 |
5 |
18214 |
76.0 |
0.5 |
0.716 |
1 |
0 |
0 |
0.000 |
22 |
23 |
|
[EDO]A:510 |
4 |
1 |
185 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
5 |
18235 |
75.8 |
3.2 |
0.345 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
[EDO]B:507 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
18235 |
72.7 |
1.8 |
0.305 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[EDO]B:506 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
2 |
18235 |
71.1 |
1.9 |
0.283 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
B |
9 |
3 |
18235 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
6 |
5 |
18214 |
67.6 |
-0.4 |
0.530 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
[EDO]A:506 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
18214 |
66.9 |
2.6 |
0.332 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[EPE]B:503 |
8 |
1 |
402 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
18214 |
66.4 |
0.5 |
0.020 |
1 |
0 |
0 |
0.000 |
28 |
29 |
|
[EPE]A:503 |
8 |
1 |
404 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
18235 |
65.6 |
0.6 |
0.020 |
1 |
0 |
0 |
0.000 |
29 |
30 |
|
[3VR]A:502 |
6 |
1 |
401 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
18235 |
57.1 |
-0.6 |
0.831 |
0 |
0 |
0 |
0.012 |
31 |
|
[3VR]B:502 |
6 |
1 |
400 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
18214 |
57.0 |
-0.6 |
0.841 |
0 |
0 |
0 |
0.012 |
Average: |
57.1 |
-0.6 |
0.836 |
0 |
0 |
0 |
0.012 |
30 |
32 |
|
[PLP]A:501 |
5 |
1 |
384 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
18235 |
55.9 |
-1.9 |
0.410 |
2 |
0 |
0 |
0.030 |
31 |
33 |
|
[PLP]B:501 |
5 |
1 |
382 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
18214 |
55.7 |
-2.0 |
0.388 |
2 |
0 |
0 |
0.030 |
32 |
34 |
|
[EDO]A:510 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
18214 |
47.6 |
1.0 |
0.858 |
1 |
0 |
0 |
0.000 |
33 |
35 |
|
[EDO]A:510 |
4 |
1 |
185 |
◊ |
[EDO]A:509 |
x,y,z |
1_555 |
4 |
1 |
185 |
47.2 |
2.2 |
1.000 |
1 |
0 |
0 |
0.000 |
34 |
36 |
|
[3VR]A:502 |
5 |
1 |
401 |
f |
[PLP]A:501 |
x,y,z |
1_555 |
8 |
1 |
384 |
47.0 |
-1.2 |
0.618 |
1 |
0 |
0 |
0.017 |
35 |
37 |
|
[3VR]B:502 |
5 |
1 |
400 |
f |
[PLP]B:501 |
x,y,z |
1_555 |
8 |
1 |
382 |
46.6 |
-1.1 |
0.625 |
1 |
0 |
0 |
0.016 |
36 |
38 |
|
B |
5 |
1 |
18235 |
f |
[EDO]A:507 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
184 |
41.5 |
0.9 |
0.647 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[EPE]B:503 |
4 |
1 |
402 |
f |
[3VR]B:502 |
x,y,z |
1_555 |
2 |
1 |
400 |
36.7 |
0.0 |
0.091 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
[EPE]A:503 |
4 |
1 |
404 |
f |
[3VR]A:502 |
x,y,z |
1_555 |
2 |
1 |
401 |
36.7 |
0.0 |
0.091 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
[EDO]A:509 |
2 |
1 |
185 |
f |
B |
x,y-1,z |
1_545 |
1 |
1 |
18235 |
24.0 |
0.9 |
0.986 |
1 |
0 |
0 |
0.000 |
40 |
42 |
|
[EDO]B:507 |
1 |
1 |
184 |
f |
[EDO]B:505 |
x,y,z |
1_555 |
1 |
1 |
184 |
6.0 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
B |
1 |
1 |
18235 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
18214 |
3.9 |
0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
|