| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
933 |
233 |
57002 |
◊ |
A |
x,y,z |
1_555 |
975 |
260 |
74517 |
9450.7 |
-94.9 |
0.006 |
119 |
27 |
0 |
0.461 |
2 |
|
E |
222 |
52 |
13704 |
◊ |
A |
x,y,z |
1_555 |
245 |
74 |
74517 |
2216.9 |
-19.9 |
0.137 |
22 |
7 |
0 |
0.202 |
3 |
|
K |
214 |
48 |
8910 |
◊ |
C |
x,y,z |
1_555 |
204 |
56 |
16900 |
2107.3 |
-35.3 |
0.024 |
13 |
4 |
0 |
1.000 |
4 |
|
F |
193 |
49 |
6328 |
◊ |
A |
x,y,z |
1_555 |
211 |
56 |
74517 |
1859.5 |
-24.9 |
0.095 |
9 |
4 |
0 |
0.244 |
5 |
|
C |
196 |
45 |
16900 |
◊ |
B |
x,y,z |
1_555 |
186 |
48 |
57002 |
1722.0 |
-6.9 |
0.593 |
23 |
10 |
0 |
0.177 |
6 |
|
I |
167 |
41 |
9465 |
◊ |
A |
x,y,z |
1_555 |
172 |
42 |
74517 |
1595.2 |
-14.2 |
0.160 |
17 |
5 |
0 |
0.247 |
7 |
|
J |
148 |
31 |
4977 |
◊ |
B |
x,y,z |
1_555 |
180 |
55 |
57002 |
1540.5 |
-21.5 |
0.126 |
12 |
3 |
0 |
0.434 |
8 |
|
H |
175 |
38 |
9220 |
◊ |
A |
x,y,z |
1_555 |
159 |
46 |
74517 |
1506.1 |
-20.1 |
0.064 |
13 |
3 |
0 |
0.288 |
9 |
|
I |
161 |
38 |
9465 |
◊ |
B |
x,y,z |
1_555 |
155 |
37 |
57002 |
1455.3 |
-13.8 |
0.181 |
9 |
1 |
0 |
0.171 |
10 |
|
J |
105 |
28 |
4977 |
◊ |
C |
x,y,z |
1_555 |
122 |
36 |
16900 |
1099.4 |
-5.4 |
0.653 |
13 |
8 |
0 |
1.000 |
11 |
|
L |
100 |
23 |
4633 |
◊ |
B |
x,y,z |
1_555 |
116 |
33 |
57002 |
992.7 |
-4.9 |
0.512 |
16 |
5 |
0 |
0.121 |
12 |
|
K |
95 |
25 |
8910 |
◊ |
A |
x,y,z |
1_555 |
114 |
28 |
74517 |
984.3 |
-12.1 |
0.237 |
7 |
1 |
0 |
0.266 |
13 |
|
T |
108 |
12 |
6745 |
◊ |
A |
x,y,z |
1_555 |
109 |
34 |
74517 |
934.6 |
-6.3 |
0.729 |
10 |
0 |
0 |
0.162 |
14 |
|
N |
79 |
14 |
3532 |
◊ |
T |
x,y,z |
1_555 |
71 |
16 |
6745 |
717.4 |
-7.2 |
0.612 |
29 |
0 |
0 |
1.000 |
15 |
|
T |
85 |
11 |
6745 |
◊ |
B |
x,y,z |
1_555 |
85 |
29 |
57002 |
676.5 |
-18.7 |
0.158 |
6 |
0 |
0 |
0.254 |
16 |
|
L |
48 |
8 |
4633 |
◊ |
C |
x,y,z |
1_555 |
69 |
19 |
16900 |
546.1 |
-0.2 |
0.663 |
13 |
8 |
0 |
0.068 |
17 |
|
R |
63 |
9 |
2483 |
◊ |
B |
x,y,z |
1_555 |
73 |
29 |
57002 |
541.3 |
-10.7 |
0.534 |
5 |
0 |
0 |
0.123 |
18 |
|
A |
57 |
15 |
74517 |
◊ |
I |
-x+1/2,y-1/2,-z+1 |
4_546 |
57 |
15 |
9465 |
494.4 |
-1.6 |
0.497 |
5 |
0 |
0 |
0.000 |
19 |
|
K |
43 |
14 |
8910 |
◊ |
B |
x,y,z |
1_555 |
58 |
17 |
57002 |
469.2 |
-1.2 |
0.701 |
5 |
3 |
0 |
0.024 |
20 |
|
R |
50 |
10 |
2483 |
◊ |
T |
x,y,z |
1_555 |
58 |
11 |
6745 |
440.9 |
-3.1 |
0.707 |
18 |
0 |
0 |
0.168 |
21 |
|
C |
40 |
10 |
16900 |
◊ |
A |
x,y,z |
1_555 |
39 |
14 |
74517 |
374.8 |
-2.9 |
0.336 |
2 |
0 |
0 |
0.011 |
22 |
|
C |
39 |
9 |
16900 |
◊ |
A |
-x,y,-z |
2_555 |
40 |
10 |
74517 |
372.5 |
-0.7 |
0.647 |
6 |
2 |
0 |
0.000 |
23 |
|
L |
31 |
9 |
4633 |
◊ |
L |
-x,y,-z |
2_555 |
31 |
9 |
4633 |
287.0 |
2.5 |
0.791 |
6 |
0 |
0 |
0.000 |
24 |
|
R |
34 |
6 |
2483 |
◊ |
A |
x,y,z |
1_555 |
36 |
13 |
74517 |
281.4 |
0.3 |
0.847 |
3 |
0 |
0 |
0.016 |
25 |
|
L |
24 |
5 |
4633 |
◊ |
B |
-x,y,-z |
2_555 |
28 |
10 |
57002 |
244.2 |
-1.0 |
0.363 |
1 |
0 |
0 |
0.000 |
26 |
|
I |
30 |
7 |
9465 |
◊ |
B |
-x,y,-z+1 |
2_556 |
28 |
10 |
57002 |
239.1 |
-3.1 |
0.317 |
1 |
0 |
0 |
0.000 |
27 |
|
I |
26 |
7 |
9465 |
◊ |
I |
-x,y,-z+1 |
2_556 |
26 |
7 |
9465 |
226.7 |
0.6 |
0.676 |
6 |
0 |
0 |
0.000 |
28 |
|
K |
24 |
7 |
8910 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
9220 |
204.5 |
-1.3 |
0.548 |
0 |
0 |
0 |
0.003 |
29 |
|
N |
31 |
6 |
3532 |
◊ |
A |
x,y,z |
1_555 |
24 |
11 |
74517 |
188.3 |
3.1 |
0.880 |
1 |
0 |
0 |
0.000 |
30 |
|
H |
17 |
5 |
9220 |
◊ |
C |
x,y,z |
1_555 |
24 |
5 |
16900 |
185.1 |
-0.2 |
0.625 |
1 |
1 |
0 |
0.002 |
31 |
|
E |
17 |
7 |
13704 |
◊ |
E |
-x+1,y,-z+1 |
2_656 |
17 |
7 |
13704 |
151.3 |
-1.0 |
0.485 |
0 |
4 |
0 |
0.000 |
32 |
|
[DGT]B:1308 |
13 |
1 |
590 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
57002 |
136.3 |
-0.4 |
0.397 |
3 |
0 |
0 |
0.005 |
33 |
|
N |
17 |
3 |
3532 |
◊ |
E |
x,y,z |
1_555 |
10 |
5 |
13704 |
126.7 |
-2.2 |
0.240 |
0 |
0 |
0 |
0.005 |
34 |
|
[DGT]B:1308 |
17 |
1 |
590 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
74517 |
126.5 |
2.0 |
0.717 |
0 |
0 |
0 |
0.000 |
35 |
|
F |
16 |
6 |
6328 |
◊ |
E |
x,y,z |
1_555 |
9 |
2 |
13704 |
120.7 |
-0.0 |
0.624 |
1 |
1 |
0 |
0.004 |
36 |
|
C |
12 |
6 |
16900 |
◊ |
B |
-x,y,-z |
2_555 |
11 |
4 |
57002 |
81.6 |
0.7 |
0.735 |
1 |
0 |
0 |
0.000 |
37 |
|
T |
10 |
2 |
6745 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
13704 |
75.8 |
1.3 |
0.785 |
1 |
0 |
0 |
0.000 |
38 |
|
N |
13 |
1 |
3532 |
◊ |
T |
-x+1,y,-z+1 |
2_656 |
10 |
1 |
6745 |
71.8 |
2.5 |
0.816 |
0 |
0 |
0 |
0.000 |
39 |
|
L |
4 |
3 |
4633 |
◊ |
J |
x,y,z |
1_555 |
6 |
2 |
4977 |
54.0 |
-0.2 |
0.505 |
0 |
0 |
0 |
0.002 |
40 |
|
[ZN]A:1735 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
3 |
74517 |
45.1 |
-35.9 |
0.000 |
0 |
0 |
0 |
0.621 |
41 |
|
[ZN]B:1307 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
5 |
4 |
57002 |
45.0 |
-35.5 |
0.000 |
0 |
0 |
0 |
0.566 |
42 |
|
F |
4 |
2 |
6328 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
57002 |
41.6 |
-0.2 |
0.510 |
0 |
0 |
0 |
0.000 |
43 |
|
T |
4 |
1 |
6745 |
◊ |
T |
-x+1,y,-z+1 |
2_656 |
4 |
1 |
6745 |
37.7 |
-1.2 |
0.405 |
0 |
0 |
0 |
0.000 |
44 |
|
[MG]A:2001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
74517 |
37.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.080 |
45 |
|
H |
3 |
2 |
9220 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
3 |
2 |
57002 |
31.3 |
0.1 |
0.527 |
0 |
0 |
0 |
0.000 |
46 |
|
[DGT]B:1308 |
3 |
1 |
590 |
f |
[MG]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.031 |
47 |
|
N |
5 |
1 |
3532 |
◊ |
N |
-x+1,y,-z+1 |
2_656 |
5 |
1 |
3532 |
23.3 |
-0.5 |
0.507 |
0 |
0 |
0 |
0.000 |
48 |
|
[MG]A:2001 |
1 |
1 |
98 |
◊ |
R |
x,y,z |
1_555 |
3 |
1 |
2483 |
22.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.020 |
49 |
|
C |
2 |
1 |
16900 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
2 |
1 |
57002 |
16.4 |
-0.5 |
0.259 |
0 |
0 |
0 |
0.000 |
50 |
|
H |
2 |
1 |
9220 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
57002 |
16.0 |
0.0 |
0.342 |
0 |
0 |
0 |
0.000 |
51 |
|
B |
3 |
2 |
57002 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
2 |
57002 |
12.4 |
0.5 |
0.816 |
0 |
0 |
0 |
0.000 |
52 |
|
N |
1 |
1 |
3532 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
57002 |
10.5 |
-0.4 |
0.383 |
0 |
0 |
0 |
0.004 |
53 |
|
[ZN]B:1307 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
74517 |
9.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.012 |
54 |
|
L |
1 |
1 |
4633 |
◊ |
K |
x,y,z |
1_555 |
2 |
1 |
8910 |
8.6 |
-0.0 |
0.604 |
0 |
0 |
0 |
0.000 |
55 |
|
[ZN]A:1735 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
57002 |
8.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.010 |
56 |
|
[DGT]B:1308 |
3 |
1 |
590 |
◊ |
R |
x,y,z |
1_555 |
2 |
1 |
2483 |
7.8 |
0.4 |
0.547 |
0 |
0 |
0 |
0.000 |
57 |
|
[MG]A:2001 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
57002 |
6.0 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
58 |
|
[ZN]C:319 |
1 |
1 |
98 |
f |
A |
-x,y,-z |
2_555 |
2 |
1 |
74517 |
5.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.036 |
|