| ## |
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 |
|
D |
215 |
60 |
18990 |
◊ |
C |
x,y,z |
1_555 |
215 |
65 |
18805 |
2164.0 |
-30.5 |
0.004 |
19 |
4 |
0 |
0.193 |
2 |
|
B |
220 |
61 |
18812 |
◊ |
A |
x,y,z |
1_555 |
210 |
59 |
18933 |
2153.7 |
-27.9 |
0.009 |
21 |
5 |
0 |
0.193 |
| Average: |
2158.8 |
-29.2 |
0.006 |
20 |
5 |
0 |
0.193 |
| 2 |
3 |
|
D |
117 |
35 |
18990 |
◊ |
A |
x-1,y,z |
1_455 |
114 |
34 |
18933 |
1026.7 |
-3.5 |
0.533 |
9 |
1 |
0 |
0.000 |
4 |
|
D |
117 |
36 |
18990 |
◊ |
A |
x,y,z |
1_555 |
114 |
32 |
18933 |
991.8 |
-2.4 |
0.598 |
10 |
1 |
0 |
0.000 |
| Average: |
1009.3 |
-3.0 |
0.565 |
10 |
1 |
0 |
0.000 |
| 3 |
5 |
|
C |
95 |
31 |
18805 |
◊ |
A |
x-1,y+1,z |
1_465 |
86 |
24 |
18933 |
775.7 |
-2.5 |
0.557 |
6 |
5 |
0 |
0.000 |
6 |
|
D |
84 |
22 |
18990 |
◊ |
B |
x-1,y+1,z |
1_465 |
95 |
32 |
18812 |
755.8 |
-2.1 |
0.586 |
5 |
6 |
0 |
0.000 |
| Average: |
765.7 |
-2.3 |
0.572 |
6 |
6 |
0 |
0.000 |
| 4 |
7 |
|
C |
50 |
15 |
18805 |
◊ |
B |
x-2,y+1,z+1 |
1_366 |
46 |
15 |
18812 |
385.9 |
-1.7 |
0.401 |
4 |
0 |
0 |
0.000 |
8 |
|
C |
42 |
13 |
18805 |
◊ |
B |
x-1,y+1,z+1 |
1_466 |
43 |
13 |
18812 |
347.6 |
-1.6 |
0.397 |
2 |
0 |
0 |
0.000 |
| Average: |
366.8 |
-1.6 |
0.399 |
3 |
0 |
0 |
0.000 |
| 5 |
9 |
|
[DTT]C:1456 |
8 |
1 |
300 |
f |
C |
x,y,z |
1_555 |
26 |
15 |
18805 |
193.7 |
-3.9 |
0.477 |
3 |
0 |
0 |
0.026 |
| 6 |
10 |
|
[URP]D:1456 |
9 |
1 |
279 |
f |
D |
x,y,z |
1_555 |
22 |
9 |
18990 |
150.5 |
0.1 |
0.545 |
3 |
0 |
0 |
0.006 |
11 |
|
[URP]B:1456 |
9 |
1 |
282 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
18812 |
149.6 |
1.2 |
0.583 |
3 |
0 |
0 |
0.006 |
| Average: |
150.0 |
0.6 |
0.564 |
3 |
0 |
0 |
0.006 |
| 7 |
12 |
|
[URP]C:1457 |
9 |
1 |
285 |
f |
C |
x,y,z |
1_555 |
24 |
8 |
18805 |
150.1 |
0.0 |
0.573 |
3 |
0 |
0 |
0.006 |
| 8 |
13 |
|
[URP]B:1456 |
8 |
1 |
282 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
18933 |
88.7 |
-0.1 |
0.520 |
1 |
0 |
0 |
0.003 |
14 |
|
[URP]D:1456 |
8 |
1 |
279 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
18805 |
83.5 |
1.6 |
0.683 |
1 |
0 |
0 |
0.003 |
| Average: |
86.1 |
0.8 |
0.602 |
1 |
0 |
0 |
0.003 |
| 9 |
15 |
|
[URP]C:1457 |
8 |
1 |
285 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
18990 |
78.4 |
1.5 |
0.589 |
0 |
0 |
0 |
0.000 |
| 10 |
16 |
|
C |
7 |
2 |
18805 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
18933 |
59.1 |
-0.1 |
0.561 |
1 |
1 |
0 |
0.000 |
17 |
|
D |
6 |
2 |
18990 |
◊ |
B |
x-1,y,z |
1_455 |
8 |
2 |
18812 |
56.2 |
-0.4 |
0.470 |
0 |
1 |
0 |
0.000 |
| Average: |
57.6 |
-0.3 |
0.516 |
1 |
1 |
0 |
0.000 |
| 11 |
18 |
|
D |
5 |
2 |
18990 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
18812 |
50.3 |
0.3 |
0.629 |
1 |
0 |
0 |
0.000 |
19 |
|
C |
4 |
2 |
18805 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
18933 |
39.4 |
-0.0 |
0.580 |
0 |
0 |
0 |
0.000 |
| Average: |
44.9 |
0.1 |
0.605 |
1 |
0 |
0 |
0.000 |
| 12 |
20 |
|
[ZN]A:1455 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
18933 |
46.5 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.351 |
21 |
|
[ZN]D:1454 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
14 |
8 |
18990 |
46.2 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.351 |
22 |
|
[ZN]C:1454 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
8 |
18805 |
45.5 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.351 |
23 |
|
[ZN]B:1454 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
18812 |
44.5 |
-34.6 |
0.000 |
0 |
0 |
0 |
0.351 |
| Average: |
45.7 |
-34.7 |
0.000 |
0 |
0 |
0 |
0.351 |
| 13 |
24 |
|
[ZN]D:1455 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
18990 |
46.0 |
-32.9 |
0.000 |
0 |
0 |
0 |
0.330 |
25 |
|
[ZN]A:1456 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
18933 |
45.6 |
-33.0 |
0.000 |
0 |
0 |
0 |
0.330 |
26 |
|
[ZN]B:1455 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
18812 |
45.5 |
-32.6 |
0.000 |
0 |
0 |
0 |
0.330 |
27 |
|
[ZN]C:1455 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
18805 |
45.3 |
-32.9 |
0.000 |
0 |
0 |
0 |
0.330 |
| Average: |
45.6 |
-32.9 |
0.000 |
0 |
0 |
0 |
0.330 |
| 14 |
28 |
|
[DTT]C:1456 |
2 |
1 |
300 |
f |
[URP]C:1457 |
x,y,z |
1_555 |
3 |
1 |
285 |
23.4 |
-0.7 |
0.399 |
1 |
0 |
0 |
0.005 |
| 15 |
29 |
|
C |
2 |
1 |
18805 |
◊ |
D |
x-1,y+1,z |
1_465 |
1 |
1 |
18990 |
17.7 |
0.9 |
0.908 |
1 |
1 |
0 |
0.000 |
30 |
|
B |
3 |
2 |
18812 |
◊ |
A |
x,y-1,z |
1_545 |
2 |
2 |
18933 |
11.9 |
0.5 |
0.812 |
0 |
0 |
0 |
0.000 |
| Average: |
14.8 |
0.7 |
0.860 |
1 |
1 |
0 |
0.000 |
| 16 |
31 |
|
[ZN]B:1455 |
1 |
1 |
98 |
f |
[ZN]B:1454 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.9 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.064 |
| 17 |
32 |
|
[ZN]D:1455 |
1 |
1 |
98 |
f |
[ZN]D:1454 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.2 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.059 |
| 18 |
33 |
|
[ZN]C:1455 |
1 |
1 |
98 |
f |
[ZN]C:1454 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.2 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.059 |
| 19 |
34 |
|
[ZN]A:1456 |
1 |
1 |
98 |
f |
[ZN]A:1455 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.9 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.060 |
|