## |
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 |
|
A |
88 |
22 |
13678 |
x |
A |
x-1,y,z |
1_455 |
97 |
23 |
13678 |
846.7 |
-4.2 |
0.314 |
10 |
1 |
0 |
0.000 |
2 |
|
B |
79 |
19 |
13657 |
x |
B |
x-1,y,z |
1_455 |
91 |
24 |
13657 |
779.6 |
-4.8 |
0.253 |
11 |
1 |
0 |
0.000 |
3 |
|
D |
78 |
21 |
13198 |
x |
D |
x-1,y,z |
1_455 |
89 |
24 |
13198 |
751.9 |
-4.8 |
0.345 |
10 |
2 |
0 |
0.000 |
4 |
|
C |
77 |
20 |
13333 |
x |
C |
x-1,y,z |
1_455 |
84 |
24 |
13333 |
714.9 |
-5.4 |
0.264 |
10 |
0 |
0 |
0.000 |
Average: |
773.3 |
-4.8 |
0.294 |
10 |
1 |
0 |
0.000 |
2 |
5 |
|
C |
54 |
16 |
13333 |
◊ |
B |
x,y-1,z |
1_545 |
52 |
14 |
13657 |
497.1 |
-1.6 |
0.468 |
9 |
1 |
0 |
0.000 |
6 |
|
A |
52 |
14 |
13678 |
◊ |
D |
x,y-1,z |
1_545 |
53 |
16 |
13198 |
489.9 |
-2.5 |
0.413 |
8 |
1 |
0 |
0.000 |
Average: |
493.5 |
-2.0 |
0.440 |
9 |
1 |
0 |
0.000 |
3 |
7 |
|
C |
56 |
16 |
13333 |
◊ |
B |
x,y,z |
1_555 |
54 |
16 |
13657 |
491.4 |
-1.0 |
0.447 |
6 |
3 |
0 |
0.000 |
8 |
|
D |
50 |
15 |
13198 |
◊ |
A |
x,y,z |
1_555 |
48 |
15 |
13678 |
453.3 |
-1.6 |
0.465 |
5 |
3 |
0 |
0.000 |
Average: |
472.3 |
-1.3 |
0.456 |
6 |
3 |
0 |
0.000 |
4 |
9 |
|
[L58]B:302 |
24 |
1 |
565 |
f |
B |
x,y,z |
1_555 |
56 |
23 |
13657 |
411.0 |
2.6 |
0.316 |
3 |
0 |
0 |
0.000 |
10 |
|
[L58]A:302 |
24 |
1 |
564 |
f |
A |
x,y,z |
1_555 |
56 |
23 |
13678 |
400.3 |
2.3 |
0.305 |
4 |
0 |
0 |
0.000 |
Average: |
405.7 |
2.4 |
0.311 |
4 |
0 |
0 |
0.000 |
5 |
11 |
|
[L58]D:302 |
24 |
1 |
573 |
f |
D |
x,y,z |
1_555 |
53 |
25 |
13198 |
409.1 |
1.3 |
0.234 |
3 |
0 |
0 |
0.002 |
12 |
|
[L58]C:302 |
24 |
1 |
571 |
f |
C |
x,y,z |
1_555 |
52 |
25 |
13333 |
405.0 |
0.6 |
0.144 |
3 |
0 |
0 |
0.002 |
Average: |
407.1 |
1.0 |
0.189 |
3 |
0 |
0 |
0.002 |
6 |
13 |
|
C |
47 |
14 |
13333 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
40 |
15 |
13657 |
389.5 |
4.0 |
0.819 |
7 |
5 |
0 |
0.000 |
14 |
|
A |
36 |
13 |
13678 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
44 |
14 |
13198 |
360.9 |
2.1 |
0.737 |
8 |
5 |
0 |
0.000 |
Average: |
375.2 |
3.0 |
0.778 |
8 |
5 |
0 |
0.000 |
7 |
15 |
|
A |
45 |
8 |
13678 |
◊ |
B |
x,y-1,z |
1_545 |
44 |
8 |
13657 |
364.0 |
-0.9 |
0.509 |
3 |
1 |
0 |
0.000 |
8 |
16 |
|
D |
25 |
7 |
13198 |
◊ |
B |
x,y,z |
1_555 |
30 |
10 |
13657 |
240.1 |
0.2 |
0.621 |
5 |
5 |
0 |
0.000 |
17 |
|
C |
25 |
7 |
13333 |
◊ |
A |
x,y,z |
1_555 |
29 |
10 |
13678 |
230.3 |
0.0 |
0.593 |
5 |
5 |
0 |
0.000 |
Average: |
235.2 |
0.1 |
0.607 |
5 |
5 |
0 |
0.000 |
9 |
18 |
|
D |
23 |
8 |
13198 |
◊ |
A |
x-1,y,z |
1_455 |
25 |
12 |
13678 |
212.9 |
2.3 |
0.826 |
4 |
4 |
0 |
0.000 |
19 |
|
C |
23 |
10 |
13333 |
◊ |
B |
x-1,y,z |
1_455 |
23 |
12 |
13657 |
212.8 |
1.7 |
0.771 |
3 |
3 |
0 |
0.000 |
Average: |
212.8 |
2.0 |
0.798 |
4 |
4 |
0 |
0.000 |
10 |
20 |
|
C |
25 |
8 |
13333 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
6 |
13678 |
204.5 |
-0.3 |
0.528 |
2 |
1 |
0 |
0.000 |
21 |
|
D |
24 |
7 |
13198 |
◊ |
B |
x-1,y,z |
1_455 |
21 |
6 |
13657 |
200.3 |
-0.3 |
0.510 |
2 |
1 |
0 |
0.000 |
Average: |
202.4 |
-0.3 |
0.519 |
2 |
1 |
0 |
0.000 |
11 |
22 |
|
[GOL]D:303 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
29 |
10 |
13198 |
146.9 |
-0.8 |
0.525 |
4 |
0 |
0 |
0.006 |
12 |
23 |
|
C |
23 |
7 |
13333 |
x |
C |
-x-1,y-1/2,-z+1 |
2_446 |
15 |
7 |
13333 |
146.4 |
-0.4 |
0.514 |
2 |
0 |
0 |
0.000 |
24 |
|
D |
14 |
7 |
13198 |
x |
D |
-x-1,y-1/2,-z |
2_445 |
19 |
6 |
13198 |
132.8 |
-1.3 |
0.336 |
0 |
0 |
0 |
0.000 |
Average: |
139.6 |
-0.9 |
0.425 |
1 |
0 |
0 |
0.000 |
13 |
25 |
|
[GOL]A:304 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
32 |
11 |
13678 |
146.3 |
-0.9 |
0.490 |
4 |
0 |
0 |
0.007 |
26 |
|
[GOL]B:306 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
33 |
10 |
13657 |
141.5 |
-0.8 |
0.507 |
5 |
0 |
0 |
0.007 |
Average: |
143.9 |
-0.9 |
0.499 |
5 |
0 |
0 |
0.007 |
14 |
27 |
|
C |
18 |
6 |
13333 |
◊ |
B |
x-1,y-1,z |
1_445 |
21 |
7 |
13657 |
145.4 |
-0.3 |
0.543 |
2 |
0 |
0 |
0.000 |
28 |
|
D |
17 |
6 |
13198 |
◊ |
A |
x-1,y+1,z |
1_465 |
21 |
6 |
13678 |
145.2 |
-0.4 |
0.526 |
2 |
0 |
0 |
0.000 |
Average: |
145.3 |
-0.3 |
0.534 |
2 |
0 |
0 |
0.000 |
15 |
29 |
|
[GOL]C:304 |
6 |
1 |
217 |
f |
C |
x,y,z |
1_555 |
31 |
10 |
13333 |
143.9 |
-0.8 |
0.509 |
4 |
0 |
0 |
0.006 |
16 |
30 |
|
[ACT]B:305 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
13657 |
126.1 |
-1.3 |
0.473 |
0 |
0 |
0 |
0.003 |
17 |
31 |
|
[ACT]B:304 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
13657 |
100.0 |
-0.8 |
0.555 |
1 |
0 |
0 |
0.003 |
18 |
32 |
|
[ACT]A:303 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
13678 |
99.9 |
-0.7 |
0.584 |
2 |
0 |
0 |
0.003 |
19 |
33 |
|
[ACT]B:303 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
13657 |
96.4 |
-1.3 |
0.509 |
1 |
0 |
0 |
0.004 |
20 |
34 |
|
[ACT]C:303 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
13678 |
69.9 |
-0.7 |
0.498 |
1 |
0 |
0 |
0.003 |
21 |
35 |
|
[ACT]C:303 |
4 |
1 |
182 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
13333 |
54.9 |
-0.5 |
0.413 |
1 |
0 |
0 |
0.000 |
22 |
36 |
|
C |
7 |
2 |
13333 |
◊ |
[ACT]B:303 |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
183 |
41.9 |
0.6 |
0.782 |
1 |
0 |
0 |
0.000 |
23 |
37 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
13657 |
36.4 |
-26.7 |
0.000 |
0 |
0 |
0 |
0.062 |
38 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
6 |
13333 |
36.3 |
-27.2 |
0.000 |
0 |
0 |
0 |
0.062 |
39 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
13678 |
36.2 |
-26.8 |
0.000 |
0 |
0 |
0 |
0.062 |
40 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
13198 |
36.1 |
-26.7 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
36.2 |
-26.9 |
0.000 |
0 |
0 |
0 |
0.062 |
24 |
41 |
|
[L58]D:302 |
4 |
1 |
573 |
f |
[ZN]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.8 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.032 |
42 |
|
[L58]B:302 |
5 |
1 |
565 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.8 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.032 |
43 |
|
[L58]A:302 |
3 |
1 |
564 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.8 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.032 |
44 |
|
[L58]C:302 |
4 |
1 |
571 |
f |
[ZN]C:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.3 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.032 |
Average: |
31.7 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.032 |
25 |
45 |
|
[ACT]A:303 |
2 |
1 |
182 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
4 |
2 |
13198 |
20.0 |
-0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
26 |
46 |
|
[GOL]B:306 |
2 |
1 |
220 |
f |
[ACT]B:305 |
x,y,z |
1_555 |
2 |
1 |
182 |
14.5 |
-0.1 |
0.661 |
0 |
0 |
0 |
0.000 |
27 |
47 |
|
A |
1 |
1 |
13678 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
13198 |
1.4 |
-0.0 |
0.585 |
0 |
0 |
0 |
0.000 |
|