| ## |
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 |
90 |
21 |
3344 |
◊ |
A |
x,y,z |
1_555 |
80 |
18 |
2103 |
843.4 |
-15.7 |
0.457 |
13 |
1 |
2 |
1.000 |
| 2 |
2 |
|
D |
81 |
21 |
3368 |
◊ |
C |
x,y,z |
1_555 |
75 |
18 |
2117 |
791.2 |
-14.1 |
0.457 |
9 |
1 |
2 |
1.000 |
| 3 |
3 |
|
D |
64 |
15 |
3368 |
◊ |
B |
x,y,z |
1_555 |
67 |
16 |
3344 |
627.6 |
-9.6 |
0.565 |
5 |
1 |
0 |
1.000 |
| 4 |
4 |
|
B |
48 |
14 |
3344 |
◊ |
D |
-y,x-y,z |
2_555 |
53 |
14 |
3368 |
465.7 |
-7.6 |
0.520 |
1 |
0 |
0 |
0.211 |
| 5 |
5 |
|
B |
16 |
3 |
3344 |
◊ |
C |
-y,x-y,z |
2_555 |
19 |
3 |
2117 |
158.6 |
-3.2 |
0.442 |
1 |
1 |
0 |
0.100 |
| 6 |
6 |
|
A |
17 |
4 |
2103 |
◊ |
C |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
20 |
5 |
2117 |
148.4 |
-0.5 |
0.820 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
A |
22 |
6 |
2103 |
◊ |
D |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
14 |
3 |
3368 |
143.3 |
-1.5 |
0.524 |
2 |
0 |
0 |
0.000 |
| 8 |
8 |
|
A |
17 |
5 |
2103 |
◊ |
D |
-y,x-y,z+1 |
2_556 |
13 |
4 |
3368 |
138.9 |
-0.9 |
0.723 |
3 |
0 |
0 |
0.024 |
| 9 |
9 |
|
C |
8 |
3 |
2117 |
◊ |
B |
x,y,z-1 |
1_554 |
11 |
2 |
3344 |
93.4 |
-0.4 |
0.706 |
1 |
0 |
0 |
0.009 |
| 10 |
10 |
|
A |
9 |
3 |
2103 |
◊ |
C |
-y,x-y,z+1 |
2_556 |
7 |
3 |
2117 |
83.2 |
-1.9 |
0.402 |
0 |
0 |
0 |
0.020 |
| 11 |
11 |
|
D |
8 |
3 |
3368 |
x |
D |
-y,x-y,z |
2_555 |
6 |
3 |
3368 |
63.1 |
-0.1 |
0.720 |
0 |
0 |
0 |
0.009 |
12 |
|
B |
3 |
1 |
3344 |
x |
B |
-y,x-y,z |
2_555 |
5 |
2 |
3344 |
52.6 |
0.0 |
0.705 |
0 |
0 |
0 |
0.009 |
| Average: |
57.9 |
-0.1 |
0.713 |
0 |
0 |
0 |
0.009 |
| 12 |
13 |
|
D |
6 |
1 |
3368 |
◊ |
B |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
9 |
3 |
3344 |
57.4 |
-0.2 |
0.668 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
D |
7 |
3 |
3368 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
1 |
3344 |
51.3 |
0.7 |
0.836 |
1 |
0 |
0 |
0.000 |
| 14 |
15 |
|
A |
5 |
3 |
2103 |
◊ |
D |
-y,x-y,z |
2_555 |
8 |
3 |
3368 |
50.1 |
-1.4 |
0.358 |
0 |
0 |
0 |
0.020 |
| 15 |
16 |
|
A |
4 |
2 |
2103 |
◊ |
C |
-y,x-y,z |
2_555 |
5 |
2 |
2117 |
49.5 |
-0.4 |
0.560 |
1 |
0 |
0 |
0.012 |
| 16 |
17 |
|
B |
6 |
1 |
3344 |
◊ |
D |
-y,x-y,z+1 |
2_556 |
6 |
1 |
3368 |
46.9 |
-0.9 |
0.522 |
0 |
0 |
0 |
0.010 |
| 17 |
18 |
|
B |
5 |
3 |
3344 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
2117 |
43.0 |
0.2 |
0.693 |
0 |
0 |
0 |
0.000 |
19 |
|
D |
4 |
2 |
3368 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
2103 |
29.7 |
-0.2 |
0.618 |
0 |
0 |
0 |
0.000 |
| Average: |
36.3 |
-0.0 |
0.656 |
0 |
0 |
0 |
0.001 |
| 18 |
20 |
|
B |
3 |
1 |
3344 |
◊ |
D |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
4 |
2 |
3368 |
41.7 |
1.0 |
0.839 |
1 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[ZN]B:501 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
3 |
1 |
3344 |
35.1 |
-16.3 |
0.000 |
0 |
0 |
0 |
1.000 |
22 |
|
[ZN]D:501 |
1 |
1 |
98 |
x |
D |
x,y,z |
1_555 |
3 |
1 |
3368 |
34.6 |
-16.3 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
34.8 |
-16.3 |
0.000 |
0 |
0 |
0 |
1.000 |
| 20 |
23 |
|
C |
4 |
2 |
2117 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
2 |
2103 |
27.8 |
-0.2 |
0.608 |
0 |
0 |
0 |
0.002 |
| 21 |
24 |
|
B |
4 |
1 |
3344 |
◊ |
C |
-y,x-y,z+1 |
2_556 |
3 |
2 |
2117 |
20.8 |
1.1 |
0.872 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
B |
3 |
1 |
3344 |
x |
B |
-x+y-1/3,-x+1/3,z-2/3 |
6_454 |
1 |
1 |
3344 |
20.0 |
1.1 |
0.913 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
C |
3 |
1 |
2117 |
x |
C |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
3 |
1 |
2117 |
17.6 |
0.1 |
0.688 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
D |
1 |
1 |
3368 |
◊ |
C |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
2 |
1 |
2117 |
16.8 |
-0.1 |
0.468 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
A |
2 |
1 |
2103 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
2 |
1 |
3344 |
15.5 |
-0.1 |
0.579 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
A |
3 |
1 |
2103 |
x |
A |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
1 |
1 |
2103 |
11.1 |
-0.0 |
0.677 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
B |
3 |
1 |
3344 |
◊ |
C |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
1 |
1 |
2117 |
4.3 |
0.1 |
0.740 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
C |
1 |
1 |
2117 |
◊ |
D |
x,y,z-1 |
1_554 |
1 |
1 |
3368 |
3.9 |
-0.0 |
0.602 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
B |
1 |
1 |
3344 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
2 |
2103 |
3.9 |
0.0 |
0.706 |
0 |
0 |
0 |
0.000 |
|