## |
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 |
|
C |
129 |
35 |
5779 |
◊ |
B |
x,y,z |
1_555 |
129 |
35 |
5881 |
1271.5 |
-16.6 |
0.080 |
14 |
0 |
0 |
0.390 |
2 |
|
D |
130 |
36 |
5797 |
◊ |
A |
x,y,z |
1_555 |
133 |
37 |
5784 |
1261.8 |
-15.9 |
0.109 |
14 |
0 |
0 |
0.390 |
Average: |
1266.7 |
-16.2 |
0.095 |
14 |
0 |
0 |
0.390 |
2 |
3 |
|
C |
50 |
14 |
5779 |
◊ |
A |
x,y,z |
1_555 |
53 |
14 |
5784 |
486.8 |
-1.5 |
0.665 |
12 |
0 |
0 |
0.098 |
4 |
|
D |
49 |
14 |
5797 |
◊ |
B |
x,y,z |
1_555 |
50 |
14 |
5881 |
481.9 |
-1.2 |
0.652 |
12 |
0 |
0 |
0.098 |
Average: |
484.3 |
-1.3 |
0.658 |
12 |
0 |
0 |
0.098 |
3 |
5 |
|
A |
42 |
14 |
5784 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
42 |
14 |
5779 |
369.5 |
-1.9 |
0.626 |
8 |
0 |
0 |
0.035 |
4 |
6 |
|
E |
38 |
9 |
1312 |
◊ |
A |
-x,y,-z |
2_555 |
48 |
15 |
5784 |
367.2 |
-3.3 |
0.773 |
3 |
0 |
0 |
0.034 |
5 |
7 |
|
B |
39 |
13 |
5881 |
◊ |
B |
-x,y,-z |
2_555 |
39 |
13 |
5881 |
305.6 |
1.0 |
0.840 |
2 |
8 |
0 |
0.000 |
6 |
8 |
|
D |
34 |
11 |
5797 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
34 |
14 |
5779 |
299.4 |
0.2 |
0.801 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
E |
26 |
5 |
1312 |
◊ |
B |
x,y,z |
1_555 |
32 |
11 |
5881 |
247.2 |
-2.7 |
0.611 |
2 |
1 |
0 |
0.166 |
8 |
10 |
|
A |
20 |
7 |
5784 |
◊ |
B |
x,y-1,z |
1_545 |
24 |
10 |
5881 |
206.5 |
-0.2 |
0.584 |
3 |
0 |
0 |
0.000 |
9 |
11 |
|
D |
21 |
10 |
5797 |
◊ |
C |
x,y,z |
1_555 |
21 |
10 |
5779 |
198.9 |
-2.4 |
0.285 |
2 |
4 |
0 |
0.056 |
12 |
|
B |
22 |
11 |
5881 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
5784 |
179.5 |
-2.3 |
0.295 |
2 |
4 |
0 |
0.056 |
Average: |
189.2 |
-2.3 |
0.290 |
2 |
4 |
0 |
0.056 |
10 |
13 |
|
D |
19 |
10 |
5797 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
20 |
8 |
5779 |
175.4 |
-1.0 |
0.504 |
1 |
0 |
0 |
0.030 |
11 |
14 |
|
[ZDC]A:201 |
12 |
1 |
328 |
◊ |
A |
x,y,z |
1_555 |
21 |
12 |
5784 |
163.4 |
0.6 |
0.525 |
2 |
0 |
0 |
0.014 |
15 |
|
[ZDC]C:201 |
12 |
1 |
329 |
◊ |
C |
x,y,z |
1_555 |
21 |
12 |
5779 |
161.6 |
0.5 |
0.517 |
2 |
0 |
0 |
0.014 |
16 |
|
[ZDC]D:201 |
12 |
1 |
330 |
◊ |
D |
x,y,z |
1_555 |
20 |
12 |
5797 |
152.3 |
0.6 |
0.529 |
2 |
0 |
0 |
0.014 |
Average: |
159.1 |
0.6 |
0.524 |
2 |
0 |
0 |
0.014 |
12 |
17 |
|
[ZDC]E:201 |
13 |
1 |
334 |
◊ |
B |
x,y,z |
1_555 |
24 |
12 |
5881 |
153.1 |
-0.7 |
0.448 |
2 |
0 |
0 |
0.070 |
13 |
18 |
|
D |
19 |
7 |
5797 |
◊ |
C |
x-1/2,y-1/2,z |
3_445 |
15 |
6 |
5779 |
140.8 |
-0.4 |
0.578 |
1 |
0 |
0 |
0.005 |
14 |
19 |
|
D |
18 |
8 |
5797 |
◊ |
D |
-x,y,-z+1 |
2_556 |
17 |
8 |
5797 |
132.5 |
-1.3 |
0.491 |
1 |
0 |
0 |
0.006 |
15 |
20 |
|
A |
12 |
5 |
5784 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
14 |
6 |
5881 |
102.7 |
-1.0 |
0.456 |
1 |
0 |
0 |
0.010 |
16 |
21 |
|
[OXE]E:202 |
8 |
1 |
276 |
cf |
E |
x,y,z |
1_555 |
10 |
4 |
1312 |
101.9 |
3.2 |
0.062 |
0 |
0 |
0 |
0.000 |
17 |
22 |
|
B |
14 |
3 |
5881 |
◊ |
A |
-x,y,-z |
2_555 |
11 |
7 |
5784 |
93.1 |
1.1 |
0.845 |
2 |
0 |
0 |
0.000 |
18 |
23 |
|
[OXE]E:202 |
7 |
1 |
276 |
◊ |
A |
-x,y,-z |
2_555 |
13 |
4 |
5784 |
60.4 |
2.1 |
0.016 |
0 |
0 |
0 |
0.000 |
19 |
24 |
|
[ZDC]E:201 |
6 |
1 |
334 |
cf |
E |
x,y,z |
1_555 |
7 |
3 |
1312 |
58.9 |
0.6 |
0.653 |
1 |
0 |
0 |
0.000 |
20 |
25 |
|
[OXE]E:202 |
3 |
1 |
276 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
5881 |
53.7 |
1.7 |
0.233 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
[ZDC]D:201 |
6 |
1 |
330 |
f |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
2 |
5779 |
52.9 |
0.1 |
0.370 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
A |
6 |
2 |
5784 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
6 |
2 |
5779 |
49.8 |
0.5 |
0.728 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
E |
6 |
3 |
1312 |
◊ |
B |
-x,y,-z |
2_555 |
2 |
2 |
5881 |
39.1 |
0.2 |
0.799 |
0 |
0 |
0 |
0.000 |
24 |
29 |
|
[ZDC]A:201 |
4 |
1 |
328 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
5797 |
35.6 |
0.6 |
0.633 |
0 |
0 |
0 |
0.000 |
30 |
|
[ZDC]D:201 |
4 |
1 |
330 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
5784 |
35.3 |
0.6 |
0.640 |
0 |
0 |
0 |
0.000 |
31 |
|
[ZDC]C:201 |
4 |
1 |
329 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
5881 |
35.2 |
0.6 |
0.647 |
0 |
0 |
0 |
0.000 |
Average: |
35.4 |
0.6 |
0.640 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
[ZDC]E:201 |
4 |
1 |
334 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
5779 |
33.9 |
0.6 |
0.651 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
[CA]D:202 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
5797 |
28.4 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.337 |
34 |
|
[CA]C:202 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
5779 |
28.2 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.337 |
35 |
|
[CA]A:202 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
5784 |
28.0 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.337 |
36 |
|
[CA]B:301 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
5881 |
27.7 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.337 |
Average: |
28.1 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.337 |
27 |
37 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
5881 |
25.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.258 |
38 |
|
[CA]D:203 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
6 |
5797 |
25.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.258 |
39 |
|
[CA]C:203 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
6 |
6 |
5779 |
25.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.258 |
40 |
|
[CA]A:203 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
5784 |
25.3 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.258 |
Average: |
25.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.258 |
28 |
41 |
|
[CA]A:202 |
1 |
1 |
85 |
◊ |
[ZDC]A:201 |
x,y,z |
1_555 |
3 |
1 |
328 |
25.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.174 |
42 |
|
[CA]C:202 |
1 |
1 |
85 |
◊ |
[ZDC]C:201 |
x,y,z |
1_555 |
3 |
1 |
329 |
25.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.174 |
43 |
|
[CA]D:202 |
1 |
1 |
85 |
◊ |
[ZDC]D:201 |
x,y,z |
1_555 |
3 |
1 |
330 |
24.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.174 |
44 |
|
[CA]B:301 |
1 |
1 |
85 |
◊ |
[ZDC]E:201 |
x,y,z |
1_555 |
4 |
1 |
334 |
23.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.174 |
Average: |
24.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.174 |
29 |
45 |
|
[CA]C:203 |
1 |
1 |
85 |
◊ |
[ZDC]C:201 |
x,y,z |
1_555 |
4 |
1 |
329 |
23.7 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.138 |
46 |
|
[CA]A:203 |
1 |
1 |
85 |
◊ |
[ZDC]A:201 |
x,y,z |
1_555 |
3 |
1 |
328 |
23.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.138 |
47 |
|
[CA]D:203 |
1 |
1 |
85 |
◊ |
[ZDC]D:201 |
x,y,z |
1_555 |
3 |
1 |
330 |
23.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.138 |
48 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
[ZDC]E:201 |
x,y,z |
1_555 |
3 |
1 |
334 |
22.1 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.138 |
Average: |
23.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.138 |
30 |
49 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
5779 |
17.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.073 |
50 |
|
[CA]C:203 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
5881 |
17.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.073 |
51 |
|
[CA]D:203 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
5784 |
17.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.073 |
52 |
|
[CA]A:203 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
5797 |
17.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.073 |
Average: |
17.2 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.073 |
31 |
53 |
|
[CA]D:203 |
1 |
1 |
85 |
f |
[CA]D:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.046 |
32 |
54 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
[CA]B:301 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.2 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.095 |
33 |
55 |
|
[CA]A:203 |
1 |
1 |
85 |
f |
[CA]A:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.1 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.093 |
34 |
56 |
|
[CA]C:203 |
1 |
1 |
85 |
f |
[CA]C:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
7.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.044 |
35 |
57 |
|
C |
1 |
1 |
5779 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
5881 |
6.5 |
0.1 |
0.760 |
0 |
0 |
0 |
0.000 |
36 |
58 |
|
[OXE]E:202 |
1 |
1 |
276 |
f |
[ZDC]E:201 |
x,y,z |
1_555 |
1 |
1 |
334 |
4.9 |
0.3 |
0.555 |
0 |
0 |
0 |
0.000 |
37 |
59 |
|
A |
1 |
1 |
5784 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
1 |
5797 |
1.9 |
-0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
38 |
60 |
|
D |
1 |
1 |
5797 |
f |
[ZDC]C:201 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
329 |
0.5 |
0.0 |
0.408 |
0 |
0 |
0 |
0.000 |
|