| ## |
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 |
145 |
42 |
24875 |
◊ |
A |
x,y,z |
1_555 |
139 |
40 |
25016 |
1324.8 |
-9.7 |
0.141 |
14 |
3 |
0 |
0.166 |
| 2 |
2 |
|
A |
66 |
26 |
25016 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
66 |
17 |
24875 |
543.5 |
1.1 |
0.699 |
9 |
1 |
0 |
0.000 |
| 3 |
3 |
|
A |
46 |
14 |
25016 |
◊ |
B |
x,y-1,z-1 |
1_544 |
48 |
19 |
24875 |
406.4 |
1.0 |
0.701 |
4 |
0 |
0 |
0.000 |
4 |
|
A |
49 |
18 |
25016 |
◊ |
B |
x,y,z-1 |
1_554 |
43 |
13 |
24875 |
403.5 |
1.9 |
0.767 |
4 |
1 |
0 |
0.000 |
| Average: |
405.0 |
1.4 |
0.734 |
4 |
1 |
0 |
0.000 |
| 4 |
5 |
|
B |
30 |
11 |
24875 |
x |
B |
x,y-1,z |
1_545 |
21 |
7 |
24875 |
227.8 |
4.6 |
0.921 |
2 |
3 |
0 |
0.000 |
6 |
|
A |
19 |
7 |
25016 |
x |
A |
x,y-1,z |
1_545 |
19 |
7 |
25016 |
160.4 |
3.3 |
0.920 |
1 |
1 |
0 |
0.000 |
| Average: |
194.1 |
4.0 |
0.920 |
2 |
2 |
0 |
0.000 |
| 5 |
7 |
|
[BDP]A:1706 |
13 |
1 |
311 |
f |
A |
x,y,z |
1_555 |
32 |
15 |
25016 |
173.9 |
4.1 |
0.642 |
11 |
0 |
0 |
0.007 |
8 |
|
[BDP]B:1705 |
13 |
1 |
310 |
f |
B |
x,y,z |
1_555 |
28 |
14 |
24875 |
172.8 |
4.1 |
0.634 |
9 |
0 |
0 |
0.007 |
| Average: |
173.3 |
4.1 |
0.638 |
10 |
0 |
0 |
0.007 |
| 6 |
9 |
|
A |
16 |
4 |
25016 |
x |
A |
x-1,y,z |
1_455 |
21 |
6 |
25016 |
167.9 |
0.8 |
0.593 |
3 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[XYP]A:1713 |
9 |
1 |
257 |
f |
A |
x,y,z |
1_555 |
27 |
13 |
25016 |
137.8 |
-3.7 |
0.440 |
3 |
0 |
0 |
0.051 |
| 8 |
11 |
|
[XYP]B:1713 |
9 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
26 |
13 |
24875 |
136.8 |
-3.7 |
0.454 |
3 |
0 |
0 |
0.051 |
| 9 |
12 |
|
[EDO]B:1709 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
24875 |
109.8 |
4.5 |
0.712 |
2 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:1710 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
25016 |
109.0 |
4.5 |
0.712 |
2 |
0 |
0 |
0.000 |
| Average: |
109.4 |
4.5 |
0.712 |
2 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[EDO]A:1707 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
29 |
11 |
25016 |
105.6 |
3.9 |
0.683 |
4 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[EDO]A:1709 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
25016 |
105.6 |
3.5 |
0.488 |
3 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:1711 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
24875 |
105.5 |
3.5 |
0.492 |
3 |
0 |
0 |
0.000 |
| Average: |
105.6 |
3.5 |
0.490 |
3 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[EDO]B:1706 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
29 |
11 |
24875 |
105.2 |
3.9 |
0.688 |
4 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[EDO]B:1708 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
24875 |
99.8 |
3.0 |
0.470 |
3 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[EDO]A:1711 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
25016 |
96.0 |
2.9 |
0.312 |
3 |
0 |
0 |
0.000 |
| 15 |
20 |
|
B |
10 |
3 |
24875 |
x |
B |
x-1,y-1,z |
1_445 |
14 |
5 |
24875 |
94.3 |
-0.0 |
0.560 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[EDO]A:1708 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
25016 |
93.9 |
2.9 |
0.449 |
3 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[EDO]B:1707 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
24875 |
93.3 |
2.7 |
0.449 |
3 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[XYP]A:1712 |
2 |
1 |
146 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
25016 |
77.1 |
-1.7 |
0.000 |
2 |
0 |
0 |
0.026 |
| 19 |
24 |
|
[XYP]B:1712 |
2 |
1 |
146 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
24875 |
76.4 |
-2.2 |
0.000 |
2 |
0 |
0 |
0.031 |
| 20 |
25 |
|
[CO]B:1715 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
24875 |
72.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.251 |
26 |
|
[CO]A:1715 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
25016 |
72.3 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.251 |
| Average: |
72.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.251 |
| 21 |
27 |
|
[CO]A:1714 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
25016 |
70.6 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.217 |
28 |
|
[CO]B:1714 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
24875 |
70.1 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.217 |
| Average: |
70.4 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.217 |
| 22 |
29 |
|
A |
11 |
5 |
25016 |
◊ |
[EDO]B:1710 |
x-1,y-1,z-1 |
1_444 |
4 |
1 |
183 |
69.9 |
2.2 |
0.271 |
1 |
0 |
0 |
0.000 |
| 23 |
30 |
|
[CO]A:1716 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
25016 |
69.3 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.205 |
31 |
|
[CO]B:1717 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
24875 |
69.2 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.205 |
| Average: |
69.3 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.205 |
| 24 |
32 |
|
[CO]B:1716 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
24875 |
62.4 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.178 |
33 |
|
[CO]A:1717 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
25016 |
61.8 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.178 |
| Average: |
62.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.178 |
| 25 |
34 |
|
[EDO]B:1710 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
24875 |
51.1 |
0.7 |
0.632 |
1 |
0 |
0 |
0.000 |
| 26 |
35 |
|
[XYP]B:1713 |
4 |
1 |
259 |
cf |
[XYP]B:1712 |
x,y,z |
1_555 |
2 |
1 |
146 |
40.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.016 |
| 27 |
36 |
|
[XYP]A:1713 |
4 |
1 |
257 |
cf |
[XYP]A:1712 |
x,y,z |
1_555 |
2 |
1 |
146 |
39.5 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.016 |
| 28 |
37 |
|
[XYP]B:1713 |
4 |
1 |
259 |
f |
[BDP]B:1705 |
x,y,z |
1_555 |
5 |
1 |
310 |
36.3 |
-0.5 |
0.540 |
0 |
0 |
0 |
0.005 |
| 29 |
38 |
|
[XYP]A:1713 |
4 |
1 |
257 |
f |
[BDP]A:1706 |
x,y,z |
1_555 |
5 |
1 |
311 |
36.1 |
-0.4 |
0.527 |
0 |
0 |
0 |
0.005 |
| 30 |
39 |
|
A |
6 |
2 |
25016 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
24875 |
27.3 |
-0.3 |
0.420 |
0 |
0 |
0 |
0.000 |
| 31 |
40 |
|
[EDO]A:1709 |
3 |
1 |
183 |
f |
[EDO]A:1707 |
x,y,z |
1_555 |
2 |
1 |
184 |
23.6 |
1.2 |
1.000 |
0 |
0 |
0 |
0.000 |
| 32 |
41 |
|
[EDO]B:1711 |
3 |
1 |
185 |
f |
[EDO]B:1706 |
x,y,z |
1_555 |
2 |
1 |
184 |
23.0 |
1.2 |
1.000 |
0 |
0 |
0 |
0.000 |
| 33 |
42 |
|
[XYP]B:1712 |
2 |
1 |
146 |
f |
[BDP]B:1705 |
x,y,z |
1_555 |
4 |
1 |
310 |
19.6 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 34 |
43 |
|
[XYP]A:1712 |
2 |
1 |
146 |
f |
[BDP]A:1706 |
x,y,z |
1_555 |
4 |
1 |
311 |
18.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 35 |
44 |
|
[CO]A:1717 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
24875 |
4.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
45 |
|
[CO]B:1716 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
25016 |
3.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
| Average: |
3.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.009 |
| 36 |
46 |
|
A |
1 |
1 |
25016 |
f |
[EDO]B:1708 |
x,y,z-1 |
1_554 |
1 |
1 |
184 |
3.1 |
-0.0 |
0.588 |
0 |
0 |
0 |
0.000 |
|