| ## |
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 |
963 |
263 |
72787 |
◊ |
C |
x,y,z |
1_555 |
921 |
234 |
58055 |
9039.5 |
-87.6 |
0.007 |
96 |
31 |
0 |
0.948 |
2 |
|
N |
899 |
234 |
73356 |
◊ |
M |
x,y,z |
1_555 |
885 |
222 |
57551 |
8531.8 |
-85.7 |
0.005 |
85 |
37 |
0 |
0.948 |
| Average: |
8785.7 |
-86.7 |
0.006 |
91 |
34 |
0 |
0.948 |
| 2 |
3 |
|
P |
408 |
115 |
24196 |
◊ |
N |
x,y,z |
1_555 |
423 |
127 |
73356 |
3919.2 |
-13.5 |
0.593 |
41 |
18 |
0 |
1.000 |
4 |
|
F |
368 |
111 |
24641 |
◊ |
D |
x,y,z |
1_555 |
401 |
124 |
72787 |
3624.4 |
-12.3 |
0.682 |
42 |
24 |
0 |
1.000 |
| Average: |
3771.8 |
-12.9 |
0.637 |
42 |
21 |
0 |
1.000 |
| 3 |
5 |
|
O |
246 |
62 |
7216 |
◊ |
N |
x,y,z |
1_555 |
233 |
60 |
73356 |
2306.7 |
-21.3 |
0.215 |
21 |
8 |
0 |
1.000 |
6 |
|
E |
224 |
57 |
7292 |
◊ |
D |
x,y,z |
1_555 |
209 |
57 |
72787 |
2141.2 |
-24.0 |
0.097 |
22 |
9 |
0 |
1.000 |
| Average: |
2224.0 |
-22.6 |
0.156 |
22 |
9 |
0 |
1.000 |
| 4 |
7 |
|
C |
226 |
58 |
58055 |
◊ |
A |
x,y,z |
1_555 |
213 |
55 |
13511 |
2015.2 |
-5.8 |
0.666 |
22 |
14 |
0 |
0.704 |
8 |
|
M |
223 |
61 |
57551 |
◊ |
K |
x,y,z |
1_555 |
212 |
56 |
13389 |
1963.5 |
-6.9 |
0.610 |
22 |
14 |
0 |
0.704 |
| Average: |
1989.3 |
-6.3 |
0.638 |
22 |
14 |
0 |
0.704 |
| 5 |
9 |
|
L |
155 |
43 |
13255 |
◊ |
K |
x,y,z |
1_555 |
159 |
43 |
13389 |
1635.8 |
-23.0 |
0.037 |
10 |
0 |
0 |
1.000 |
10 |
|
B |
163 |
44 |
13380 |
◊ |
A |
x,y,z |
1_555 |
152 |
44 |
13511 |
1617.7 |
-23.7 |
0.042 |
11 |
0 |
0 |
1.000 |
| Average: |
1626.7 |
-23.3 |
0.039 |
11 |
0 |
0 |
1.000 |
| 6 |
11 |
|
P |
175 |
49 |
24196 |
◊ |
M |
x,y,z |
1_555 |
162 |
47 |
57551 |
1491.3 |
-18.0 |
0.093 |
11 |
1 |
0 |
0.714 |
12 |
|
F |
162 |
49 |
24641 |
◊ |
C |
x,y,z |
1_555 |
161 |
48 |
58055 |
1440.9 |
-15.3 |
0.129 |
9 |
2 |
0 |
0.714 |
| Average: |
1466.1 |
-16.7 |
0.111 |
10 |
2 |
0 |
0.714 |
| 7 |
13 |
|
N |
124 |
34 |
73356 |
◊ |
L |
x,y,z |
1_555 |
125 |
36 |
13255 |
1152.0 |
-2.1 |
0.681 |
12 |
11 |
0 |
0.036 |
14 |
|
D |
92 |
28 |
72787 |
◊ |
B |
x,y,z |
1_555 |
105 |
30 |
13380 |
876.4 |
-3.2 |
0.628 |
4 |
5 |
0 |
0.036 |
| Average: |
1014.2 |
-2.6 |
0.654 |
8 |
8 |
0 |
0.036 |
| 8 |
15 |
|
D |
65 |
21 |
72787 |
◊ |
N |
-y+1,x-y+1,z-1/3 |
2_664 |
59 |
12 |
73356 |
590.6 |
-4.7 |
0.348 |
2 |
0 |
0 |
0.000 |
16 |
|
D |
48 |
11 |
72787 |
◊ |
N |
x-1,y,z |
1_455 |
48 |
17 |
73356 |
406.5 |
-2.9 |
0.359 |
2 |
0 |
0 |
0.000 |
| Average: |
498.6 |
-3.8 |
0.353 |
2 |
0 |
0 |
0.000 |
| 9 |
17 |
|
C |
55 |
20 |
58055 |
◊ |
P |
x-1,y,z |
1_455 |
68 |
16 |
24196 |
529.8 |
-4.9 |
0.295 |
0 |
0 |
0 |
0.000 |
| 10 |
18 |
|
F |
63 |
22 |
24641 |
◊ |
N |
-y+1,x-y+1,z-1/3 |
2_664 |
74 |
25 |
73356 |
520.7 |
3.1 |
0.796 |
4 |
6 |
0 |
0.000 |
19 |
|
D |
64 |
24 |
72787 |
◊ |
P |
x-1,y,z |
1_455 |
54 |
17 |
24196 |
510.7 |
0.1 |
0.661 |
8 |
6 |
0 |
0.000 |
| Average: |
515.7 |
1.6 |
0.729 |
6 |
6 |
0 |
0.000 |
| 11 |
20 |
|
[RBT]M:8002 |
43 |
1 |
1065 |
f |
M |
x,y,z |
1_555 |
67 |
23 |
57551 |
483.8 |
-4.9 |
0.669 |
14 |
0 |
0 |
0.372 |
21 |
|
[RBT]C:8001 |
41 |
1 |
1073 |
f |
C |
x,y,z |
1_555 |
62 |
23 |
58055 |
470.8 |
-2.1 |
0.846 |
12 |
0 |
0 |
0.372 |
| Average: |
477.3 |
-3.5 |
0.758 |
13 |
0 |
0 |
0.372 |
| 12 |
22 |
|
C |
26 |
10 |
58055 |
◊ |
B |
x,y,z |
1_555 |
27 |
7 |
13380 |
263.3 |
2.9 |
0.896 |
3 |
3 |
0 |
0.000 |
23 |
|
M |
28 |
11 |
57551 |
◊ |
L |
x,y,z |
1_555 |
19 |
5 |
13255 |
202.5 |
2.5 |
0.847 |
2 |
2 |
0 |
0.000 |
| Average: |
232.9 |
2.7 |
0.872 |
3 |
3 |
0 |
0.000 |
| 13 |
24 |
|
A |
40 |
13 |
13511 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
27 |
10 |
72787 |
262.9 |
0.4 |
0.721 |
1 |
1 |
0 |
0.000 |
25 |
|
K |
30 |
11 |
13389 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
26 |
9 |
73356 |
250.9 |
1.3 |
0.779 |
3 |
3 |
0 |
0.000 |
| Average: |
256.9 |
0.8 |
0.750 |
2 |
2 |
0 |
0.000 |
| 14 |
26 |
|
F |
31 |
10 |
24641 |
◊ |
M |
-y+1,x-y+1,z-1/3 |
2_664 |
34 |
14 |
57551 |
256.8 |
-2.4 |
0.414 |
0 |
0 |
0 |
0.000 |
| 15 |
27 |
|
K |
20 |
6 |
13389 |
◊ |
F |
x,y-1,z |
1_545 |
21 |
8 |
24641 |
204.7 |
-1.3 |
0.489 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
13 |
4 |
13511 |
◊ |
P |
-y+1,x-y,z-1/3 |
2_654 |
13 |
5 |
24196 |
99.0 |
0.7 |
0.633 |
0 |
0 |
0 |
0.000 |
| Average: |
151.8 |
-0.3 |
0.561 |
0 |
0 |
0 |
0.000 |
| 16 |
29 |
|
O |
29 |
9 |
7216 |
◊ |
M |
x,y,z |
1_555 |
27 |
11 |
57551 |
192.2 |
-0.7 |
0.610 |
2 |
1 |
0 |
0.010 |
30 |
|
E |
14 |
5 |
7292 |
◊ |
C |
x,y,z |
1_555 |
18 |
7 |
58055 |
128.2 |
1.1 |
0.728 |
3 |
1 |
0 |
0.010 |
| Average: |
160.2 |
0.2 |
0.669 |
3 |
1 |
0 |
0.010 |
| 17 |
31 |
|
C |
26 |
10 |
58055 |
◊ |
N |
x-1,y,z |
1_455 |
13 |
7 |
73356 |
163.9 |
1.6 |
0.789 |
0 |
0 |
0 |
0.000 |
| 18 |
32 |
|
D |
9 |
3 |
72787 |
◊ |
M |
-y+1,x-y+1,z-1/3 |
2_664 |
11 |
4 |
57551 |
102.4 |
1.0 |
0.788 |
2 |
1 |
0 |
0.000 |
| 19 |
33 |
|
K |
13 |
5 |
13389 |
◊ |
D |
x,y-1,z |
1_545 |
13 |
7 |
72787 |
97.6 |
-0.4 |
0.501 |
0 |
0 |
0 |
0.000 |
| 20 |
34 |
|
[RBT]C:8001 |
10 |
1 |
1073 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
24641 |
80.0 |
-0.4 |
0.703 |
0 |
0 |
0 |
0.015 |
| 21 |
35 |
|
[RBT]M:8002 |
8 |
1 |
1065 |
◊ |
P |
x,y,z |
1_555 |
7 |
2 |
24196 |
71.1 |
-1.2 |
0.575 |
0 |
0 |
0 |
0.035 |
| 22 |
36 |
|
B |
5 |
1 |
13380 |
◊ |
D |
-y+1,x-y+1,z-1/3 |
2_664 |
5 |
3 |
72787 |
43.1 |
-0.4 |
0.495 |
0 |
0 |
0 |
0.000 |
| 23 |
37 |
|
D |
3 |
1 |
72787 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
13511 |
18.3 |
-0.0 |
0.627 |
0 |
0 |
0 |
0.000 |
38 |
|
N |
2 |
1 |
73356 |
◊ |
K |
x,y,z |
1_555 |
4 |
1 |
13389 |
10.2 |
0.9 |
0.812 |
0 |
0 |
0 |
0.000 |
| Average: |
14.3 |
0.4 |
0.720 |
0 |
0 |
0 |
0.000 |
| 24 |
39 |
|
L |
3 |
3 |
13255 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
2 |
72787 |
13.6 |
0.2 |
0.699 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
2 |
1 |
13380 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
3 |
1 |
73356 |
7.6 |
0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
| Average: |
10.6 |
0.1 |
0.666 |
0 |
0 |
0 |
0.000 |
| 25 |
41 |
|
L |
1 |
1 |
13255 |
◊ |
N |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
73356 |
0.8 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
|