| ## |
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 |
186 |
47 |
12284 |
◊ |
A |
x,y,z |
1_555 |
184 |
46 |
12552 |
1867.9 |
-34.3 |
0.008 |
14 |
0 |
0 |
0.554 |
2 |
|
D |
179 |
45 |
12197 |
◊ |
B |
x,y,z |
1_555 |
183 |
47 |
12513 |
1832.9 |
-35.3 |
0.007 |
12 |
0 |
0 |
0.554 |
| Average: |
1850.4 |
-34.8 |
0.007 |
13 |
0 |
0 |
0.554 |
| 2 |
3 |
|
D |
153 |
39 |
12197 |
◊ |
C |
x,y,z |
1_555 |
152 |
39 |
12284 |
1357.2 |
-22.7 |
0.086 |
11 |
0 |
0 |
0.443 |
4 |
|
B |
151 |
39 |
12513 |
◊ |
A |
x,y,z |
1_555 |
155 |
39 |
12552 |
1348.4 |
-22.7 |
0.077 |
9 |
0 |
0 |
0.443 |
| Average: |
1352.8 |
-22.7 |
0.081 |
10 |
0 |
0 |
0.443 |
| 3 |
5 |
|
[NAP]D:1269 |
46 |
1 |
882 |
f |
D |
x,y,z |
1_555 |
88 |
33 |
12197 |
582.7 |
-1.0 |
0.726 |
16 |
0 |
0 |
0.265 |
6 |
|
[NAP]A:1269 |
45 |
1 |
883 |
f |
A |
x,y,z |
1_555 |
93 |
34 |
12552 |
581.7 |
-0.7 |
0.732 |
16 |
0 |
0 |
0.265 |
7 |
|
[NAP]B:1269 |
44 |
1 |
882 |
f |
B |
x,y,z |
1_555 |
87 |
32 |
12513 |
578.8 |
-0.7 |
0.740 |
16 |
0 |
0 |
0.265 |
8 |
|
[NAP]C:1269 |
45 |
1 |
881 |
f |
C |
x,y,z |
1_555 |
89 |
33 |
12284 |
578.0 |
-0.8 |
0.743 |
17 |
0 |
0 |
0.265 |
| Average: |
580.3 |
-0.8 |
0.735 |
16 |
0 |
0 |
0.265 |
| 4 |
9 |
|
D |
61 |
16 |
12197 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
12552 |
537.7 |
-5.3 |
0.472 |
4 |
0 |
0 |
0.064 |
10 |
|
C |
57 |
15 |
12284 |
◊ |
B |
x,y,z |
1_555 |
57 |
15 |
12513 |
532.4 |
-6.0 |
0.384 |
2 |
0 |
0 |
0.064 |
| Average: |
535.1 |
-5.6 |
0.428 |
3 |
0 |
0 |
0.064 |
| 5 |
11 |
|
B |
44 |
14 |
12513 |
◊ |
C |
x-1,y,z-1 |
1_454 |
49 |
17 |
12284 |
395.7 |
-2.6 |
0.605 |
4 |
0 |
0 |
0.028 |
| 6 |
12 |
|
A |
43 |
14 |
12552 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
41 |
12 |
12513 |
368.3 |
0.6 |
0.839 |
6 |
5 |
0 |
0.000 |
| 7 |
13 |
|
[H0V]B:1270 |
19 |
1 |
456 |
f |
B |
x,y,z |
1_555 |
47 |
17 |
12513 |
274.6 |
-4.2 |
0.358 |
2 |
0 |
0 |
0.185 |
14 |
|
[H0V]A:1270 |
19 |
1 |
455 |
f |
A |
x,y,z |
1_555 |
44 |
17 |
12552 |
273.2 |
-4.2 |
0.331 |
4 |
0 |
0 |
0.185 |
15 |
|
[H0V]C:1270 |
19 |
1 |
453 |
f |
C |
x,y,z |
1_555 |
46 |
17 |
12284 |
272.3 |
-4.2 |
0.355 |
3 |
0 |
0 |
0.185 |
16 |
|
[H0V]D:1270 |
19 |
1 |
451 |
f |
D |
x,y,z |
1_555 |
46 |
17 |
12197 |
269.5 |
-4.2 |
0.356 |
4 |
0 |
0 |
0.185 |
| Average: |
272.4 |
-4.2 |
0.350 |
3 |
0 |
0 |
0.185 |
| 8 |
17 |
|
D |
23 |
6 |
12197 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
6 |
12552 |
229.3 |
-2.7 |
0.419 |
2 |
0 |
0 |
0.000 |
| 9 |
18 |
|
D |
21 |
7 |
12197 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
20 |
7 |
12284 |
171.3 |
0.4 |
0.770 |
0 |
0 |
0 |
0.000 |
| 10 |
19 |
|
[H0V]B:1270 |
14 |
1 |
456 |
f |
[NAP]B:1269 |
x,y,z |
1_555 |
17 |
1 |
882 |
126.6 |
-1.6 |
0.469 |
2 |
0 |
0 |
0.083 |
20 |
|
[H0V]A:1270 |
14 |
1 |
455 |
f |
[NAP]A:1269 |
x,y,z |
1_555 |
17 |
1 |
883 |
126.2 |
-1.6 |
0.451 |
2 |
0 |
0 |
0.083 |
21 |
|
[H0V]C:1270 |
14 |
1 |
453 |
f |
[NAP]C:1269 |
x,y,z |
1_555 |
18 |
1 |
881 |
125.9 |
-1.7 |
0.473 |
2 |
0 |
0 |
0.083 |
22 |
|
[H0V]D:1270 |
14 |
1 |
451 |
f |
[NAP]D:1269 |
x,y,z |
1_555 |
16 |
1 |
882 |
125.4 |
-1.7 |
0.428 |
2 |
0 |
0 |
0.083 |
| Average: |
126.0 |
-1.7 |
0.455 |
2 |
0 |
0 |
0.083 |
| 11 |
23 |
|
B |
11 |
3 |
12513 |
◊ |
D |
x,y,z-1 |
1_554 |
9 |
4 |
12197 |
95.0 |
0.4 |
0.768 |
3 |
0 |
0 |
0.000 |
| 12 |
24 |
|
[ACT]A:1273 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
12552 |
81.3 |
0.4 |
0.818 |
0 |
0 |
0 |
0.000 |
| 13 |
25 |
|
[ACT]C:1271 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
12284 |
81.3 |
-1.1 |
0.435 |
1 |
0 |
0 |
0.024 |
| 14 |
26 |
|
[ACT]A:1271 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
12552 |
76.4 |
-0.6 |
0.660 |
1 |
0 |
0 |
0.017 |
| 15 |
27 |
|
B |
7 |
5 |
12513 |
◊ |
[ACT]C:1271 |
x-1,y,z-1 |
1_454 |
4 |
1 |
183 |
72.9 |
-0.8 |
0.492 |
1 |
0 |
0 |
0.008 |
| 16 |
28 |
|
[ACT]A:1271 |
4 |
1 |
183 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
12 |
7 |
12513 |
72.6 |
-0.3 |
0.719 |
1 |
0 |
0 |
0.000 |
| 17 |
29 |
|
[ACT]A:1272 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12552 |
66.6 |
0.2 |
0.744 |
1 |
0 |
0 |
0.004 |
| 18 |
30 |
|
[ACT]A:1273 |
4 |
1 |
184 |
f |
B |
-x,y-1/2,-z |
2_545 |
10 |
3 |
12513 |
60.2 |
-0.6 |
0.665 |
0 |
0 |
0 |
0.010 |
| 19 |
31 |
|
[ACT]A:1272 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
12513 |
43.2 |
-0.1 |
0.645 |
0 |
0 |
0 |
0.002 |
| 20 |
32 |
|
A |
3 |
3 |
12552 |
◊ |
C |
x,y,z-1 |
1_554 |
6 |
3 |
12284 |
27.5 |
0.1 |
0.658 |
0 |
0 |
0 |
0.000 |
| 21 |
33 |
|
D |
3 |
2 |
12197 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
2 |
12284 |
16.3 |
0.2 |
0.726 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
2 |
2 |
12513 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
2 |
12552 |
12.6 |
0.2 |
0.750 |
0 |
0 |
0 |
0.000 |
| Average: |
14.4 |
0.2 |
0.738 |
0 |
0 |
0 |
0.000 |
| 22 |
35 |
|
[ACT]A:1272 |
1 |
1 |
182 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
12552 |
8.2 |
-0.0 |
0.642 |
0 |
0 |
0 |
0.000 |
| 23 |
36 |
|
A |
2 |
2 |
12552 |
x |
A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
12552 |
6.4 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
| 24 |
37 |
|
[H0V]D:1270 |
1 |
1 |
451 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12552 |
0.1 |
-0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
|