| ## |
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 |
945 |
259 |
72812 |
◊ |
C |
x,y,z |
1_555 |
897 |
223 |
57885 |
8895.8 |
-87.3 |
0.006 |
79 |
28 |
0 |
0.888 |
2 |
|
N |
869 |
235 |
72948 |
◊ |
M |
x,y,z |
1_555 |
858 |
210 |
57869 |
8506.4 |
-86.3 |
0.004 |
88 |
36 |
0 |
0.888 |
| Average: |
8701.1 |
-86.8 |
0.005 |
84 |
32 |
0 |
0.888 |
| 2 |
3 |
|
P |
403 |
114 |
24171 |
◊ |
N |
x,y,z |
1_555 |
433 |
128 |
72948 |
3905.0 |
-19.5 |
0.571 |
45 |
16 |
0 |
0.762 |
4 |
|
F |
389 |
114 |
24398 |
◊ |
D |
x,y,z |
1_555 |
419 |
126 |
72812 |
3731.9 |
-12.9 |
0.655 |
42 |
21 |
0 |
0.762 |
| Average: |
3818.5 |
-16.2 |
0.613 |
44 |
19 |
0 |
0.762 |
| 3 |
5 |
|
O |
246 |
60 |
7225 |
◊ |
N |
x,y,z |
1_555 |
226 |
61 |
72948 |
2283.7 |
-22.4 |
0.169 |
21 |
7 |
0 |
0.715 |
6 |
|
E |
219 |
57 |
7053 |
◊ |
D |
x,y,z |
1_555 |
215 |
60 |
72812 |
2157.1 |
-21.9 |
0.202 |
23 |
9 |
0 |
0.715 |
| Average: |
2220.4 |
-22.2 |
0.185 |
22 |
8 |
0 |
0.715 |
| 4 |
7 |
|
C |
230 |
62 |
57885 |
◊ |
A |
x,y,z |
1_555 |
216 |
58 |
13535 |
2084.9 |
-1.1 |
0.801 |
24 |
21 |
0 |
1.000 |
8 |
|
M |
221 |
61 |
57869 |
◊ |
K |
x,y,z |
1_555 |
210 |
58 |
13475 |
1995.5 |
-3.9 |
0.714 |
22 |
16 |
0 |
1.000 |
| Average: |
2040.2 |
-2.5 |
0.757 |
23 |
19 |
0 |
1.000 |
| 5 |
9 |
|
L |
163 |
44 |
13178 |
◊ |
K |
x,y,z |
1_555 |
164 |
43 |
13475 |
1582.3 |
-25.2 |
0.028 |
9 |
0 |
0 |
1.000 |
10 |
|
B |
152 |
41 |
13449 |
◊ |
A |
x,y,z |
1_555 |
158 |
43 |
13535 |
1582.0 |
-25.0 |
0.020 |
9 |
0 |
0 |
1.000 |
| Average: |
1582.2 |
-25.1 |
0.024 |
9 |
0 |
0 |
1.000 |
| 6 |
11 |
|
P |
175 |
51 |
24171 |
◊ |
M |
x,y,z |
1_555 |
168 |
44 |
57869 |
1569.6 |
-21.3 |
0.069 |
7 |
0 |
0 |
1.000 |
12 |
|
F |
155 |
47 |
24398 |
◊ |
C |
x,y,z |
1_555 |
147 |
44 |
57885 |
1389.9 |
-12.2 |
0.218 |
10 |
7 |
0 |
1.000 |
| Average: |
1479.8 |
-16.7 |
0.143 |
9 |
4 |
0 |
1.000 |
| 7 |
13 |
|
N |
125 |
38 |
72948 |
◊ |
L |
x,y,z |
1_555 |
146 |
39 |
13178 |
1242.9 |
-5.4 |
0.623 |
11 |
12 |
0 |
0.045 |
14 |
|
D |
90 |
27 |
72812 |
◊ |
B |
x,y,z |
1_555 |
101 |
28 |
13449 |
869.9 |
-2.5 |
0.665 |
7 |
6 |
0 |
0.045 |
| Average: |
1056.4 |
-4.0 |
0.644 |
9 |
9 |
0 |
0.045 |
| 8 |
15 |
|
D |
60 |
20 |
72812 |
◊ |
N |
-y+1,x-y+1,z-1/3 |
2_664 |
53 |
11 |
72948 |
564.3 |
-4.1 |
0.291 |
2 |
1 |
0 |
0.000 |
16 |
|
D |
43 |
11 |
72812 |
◊ |
N |
x-1,y,z |
1_455 |
51 |
19 |
72948 |
410.5 |
-2.9 |
0.427 |
1 |
0 |
0 |
0.000 |
| Average: |
487.4 |
-3.5 |
0.359 |
2 |
1 |
0 |
0.000 |
| 9 |
17 |
|
C |
62 |
21 |
57885 |
◊ |
P |
x-1,y,z |
1_455 |
68 |
15 |
24171 |
538.6 |
-5.3 |
0.295 |
0 |
0 |
0 |
0.000 |
| 10 |
18 |
|
D |
65 |
22 |
72812 |
◊ |
P |
x-1,y,z |
1_455 |
48 |
17 |
24171 |
514.9 |
1.2 |
0.688 |
6 |
3 |
0 |
0.000 |
19 |
|
F |
52 |
20 |
24398 |
◊ |
N |
-y+1,x-y+1,z-1/3 |
2_664 |
65 |
23 |
72948 |
464.6 |
2.1 |
0.683 |
4 |
6 |
0 |
0.000 |
| Average: |
489.8 |
1.7 |
0.686 |
5 |
5 |
0 |
0.000 |
| 11 |
20 |
|
F |
28 |
10 |
24398 |
◊ |
M |
-y+1,x-y+1,z-1/3 |
2_664 |
32 |
12 |
57869 |
270.8 |
-1.6 |
0.471 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
A |
39 |
14 |
13535 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
30 |
11 |
72812 |
270.0 |
0.7 |
0.734 |
3 |
3 |
0 |
0.000 |
22 |
|
K |
35 |
14 |
13475 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
29 |
11 |
72948 |
256.5 |
2.4 |
0.844 |
3 |
4 |
0 |
0.000 |
| Average: |
263.2 |
1.5 |
0.789 |
3 |
4 |
0 |
0.000 |
| 13 |
23 |
|
K |
28 |
8 |
13475 |
◊ |
F |
x,y-1,z |
1_545 |
31 |
11 |
24398 |
261.8 |
-0.3 |
0.595 |
1 |
2 |
0 |
0.000 |
24 |
|
A |
16 |
6 |
13535 |
◊ |
P |
-y+1,x-y,z-1/3 |
2_654 |
14 |
6 |
24171 |
138.1 |
1.1 |
0.601 |
1 |
2 |
0 |
0.000 |
| Average: |
200.0 |
0.4 |
0.598 |
1 |
2 |
0 |
0.000 |
| 14 |
25 |
|
C |
27 |
10 |
57885 |
◊ |
B |
x,y,z |
1_555 |
27 |
7 |
13449 |
257.6 |
3.2 |
0.905 |
3 |
4 |
0 |
0.002 |
26 |
|
M |
26 |
9 |
57869 |
◊ |
L |
x,y,z |
1_555 |
23 |
6 |
13178 |
226.7 |
1.7 |
0.819 |
2 |
6 |
0 |
0.002 |
| Average: |
242.1 |
2.5 |
0.862 |
3 |
5 |
0 |
0.002 |
| 15 |
27 |
|
O |
26 |
10 |
7225 |
◊ |
M |
x,y,z |
1_555 |
29 |
10 |
57869 |
216.3 |
0.1 |
0.685 |
0 |
2 |
0 |
0.001 |
28 |
|
E |
20 |
6 |
7053 |
◊ |
C |
x,y,z |
1_555 |
18 |
8 |
57885 |
134.9 |
0.2 |
0.663 |
1 |
0 |
0 |
0.001 |
| Average: |
175.6 |
0.1 |
0.674 |
1 |
1 |
0 |
0.001 |
| 16 |
29 |
|
[TGT]N:9002 |
18 |
1 |
515 |
f |
N |
x,y,z |
1_555 |
21 |
8 |
72948 |
203.3 |
3.7 |
0.648 |
6 |
0 |
0 |
0.000 |
30 |
|
[TGT]D:9001 |
17 |
1 |
514 |
f |
D |
x,y,z |
1_555 |
21 |
8 |
72812 |
193.5 |
3.5 |
0.632 |
6 |
0 |
0 |
0.000 |
| Average: |
198.4 |
3.6 |
0.640 |
6 |
0 |
0 |
0.000 |
| 17 |
31 |
|
K |
19 |
5 |
13475 |
◊ |
D |
x,y-1,z |
1_545 |
18 |
8 |
72812 |
178.2 |
0.2 |
0.636 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
1 |
1 |
13535 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
72948 |
2.4 |
-0.1 |
0.426 |
0 |
0 |
0 |
0.000 |
| Average: |
90.3 |
0.1 |
0.531 |
0 |
0 |
0 |
0.000 |
| 18 |
33 |
|
C |
21 |
6 |
57885 |
◊ |
N |
x-1,y,z |
1_455 |
15 |
8 |
72948 |
165.8 |
2.1 |
0.801 |
1 |
2 |
0 |
0.000 |
| 19 |
34 |
|
[TGT]D:9001 |
13 |
1 |
514 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
57885 |
101.2 |
2.6 |
0.779 |
4 |
0 |
0 |
0.002 |
35 |
|
[TGT]N:9002 |
10 |
1 |
515 |
◊ |
M |
x,y,z |
1_555 |
15 |
4 |
57869 |
85.9 |
2.0 |
0.732 |
5 |
0 |
0 |
0.002 |
| Average: |
93.5 |
2.3 |
0.755 |
5 |
0 |
0 |
0.002 |
| 20 |
36 |
|
D |
8 |
3 |
72812 |
◊ |
M |
-y+1,x-y+1,z-1/3 |
2_664 |
7 |
3 |
57869 |
83.5 |
1.2 |
0.820 |
2 |
1 |
0 |
0.000 |
| 21 |
37 |
|
[MG]N:9005 |
1 |
1 |
98 |
f |
N |
x,y,z |
1_555 |
6 |
4 |
72948 |
50.1 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.186 |
38 |
|
[MG]D:9003 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
72812 |
49.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.186 |
| Average: |
49.9 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.186 |
| 22 |
39 |
|
[MG]N:9006 |
1 |
1 |
98 |
f |
N |
x,y,z |
1_555 |
6 |
3 |
72948 |
37.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.076 |
40 |
|
[MG]C:9004 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
72812 |
36.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.076 |
| Average: |
37.0 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.076 |
| 23 |
41 |
|
[MG]N:9006 |
1 |
1 |
98 |
◊ |
M |
x,y,z |
1_555 |
5 |
4 |
57869 |
33.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.023 |
42 |
|
[MG]C:9004 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
57885 |
31.0 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.023 |
| Average: |
32.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| 24 |
43 |
|
B |
5 |
1 |
13449 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
5 |
3 |
72812 |
32.8 |
-0.2 |
0.550 |
0 |
0 |
0 |
0.000 |
| 25 |
44 |
|
[TGT]D:9001 |
3 |
1 |
514 |
f |
[MG]C:9004 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.048 |
45 |
|
[TGT]N:9002 |
3 |
1 |
515 |
f |
[MG]N:9006 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
25.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.048 |
| 26 |
46 |
|
L |
4 |
4 |
13178 |
◊ |
D |
x,y-1,z |
1_545 |
4 |
2 |
72812 |
24.8 |
0.3 |
0.716 |
0 |
0 |
0 |
0.000 |
47 |
|
B |
7 |
3 |
13449 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
3 |
2 |
72948 |
24.6 |
0.7 |
0.807 |
0 |
0 |
0 |
0.000 |
| Average: |
24.7 |
0.5 |
0.762 |
0 |
0 |
0 |
0.000 |
| 27 |
48 |
|
E |
3 |
1 |
7053 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
13449 |
21.0 |
0.2 |
0.693 |
0 |
0 |
0 |
0.000 |
| 28 |
49 |
|
N |
2 |
1 |
72948 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
13475 |
13.2 |
0.5 |
0.813 |
0 |
0 |
0 |
0.000 |
| 29 |
50 |
|
L |
2 |
1 |
13178 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
2 |
1 |
72948 |
7.0 |
-0.1 |
0.503 |
0 |
0 |
0 |
0.000 |
| 30 |
51 |
|
[MG]N:9006 |
1 |
1 |
98 |
f |
[MG]N:9005 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.005 |
| 31 |
52 |
|
N |
1 |
1 |
72948 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
72812 |
0.3 |
-0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
| 32 |
53 |
|
[MG]D:9003 |
1 |
1 |
98 |
f |
[MG]C:9004 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|