| ## |
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 |
|
C |
67 |
17 |
9242 |
◊ |
A |
x,y,z |
1_555 |
78 |
22 |
9155 |
705.2 |
-9.1 |
0.169 |
6 |
0 |
0 |
0.281 |
2 |
|
F |
69 |
18 |
9335 |
◊ |
D |
x,y,z |
1_555 |
80 |
23 |
9338 |
703.7 |
-10.2 |
0.134 |
7 |
0 |
0 |
0.281 |
3 |
|
E |
66 |
16 |
9376 |
◊ |
C |
x,y,z |
1_555 |
78 |
23 |
9242 |
697.9 |
-9.9 |
0.134 |
6 |
0 |
0 |
0.281 |
4 |
|
E |
76 |
23 |
9376 |
◊ |
A |
x,y,z |
1_555 |
68 |
16 |
9155 |
695.3 |
-7.8 |
0.217 |
7 |
0 |
0 |
0.281 |
5 |
|
D |
66 |
17 |
9338 |
◊ |
B |
x,y,z |
1_555 |
82 |
23 |
9242 |
687.8 |
-10.1 |
0.131 |
6 |
0 |
0 |
0.281 |
6 |
|
F |
72 |
23 |
9335 |
◊ |
B |
x,y,z |
1_555 |
63 |
15 |
9242 |
663.7 |
-9.6 |
0.134 |
5 |
0 |
0 |
0.281 |
| Average: |
692.3 |
-9.5 |
0.153 |
6 |
0 |
0 |
0.281 |
| 2 |
7 |
|
B |
70 |
16 |
9242 |
◊ |
A |
x,y,z |
1_555 |
73 |
17 |
9155 |
655.9 |
-11.0 |
0.069 |
9 |
3 |
0 |
0.192 |
8 |
|
F |
71 |
16 |
9335 |
◊ |
C |
x,y,z |
1_555 |
73 |
17 |
9242 |
655.5 |
-10.8 |
0.092 |
11 |
4 |
0 |
0.192 |
9 |
|
E |
70 |
16 |
9376 |
◊ |
D |
x,y,z |
1_555 |
74 |
18 |
9338 |
654.2 |
-9.8 |
0.100 |
12 |
3 |
0 |
0.192 |
| Average: |
655.2 |
-10.5 |
0.087 |
11 |
3 |
0 |
0.192 |
| 3 |
10 |
|
C |
50 |
16 |
9242 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
51 |
12 |
9242 |
465.7 |
-1.1 |
0.639 |
4 |
1 |
0 |
0.020 |
11 |
|
A |
49 |
11 |
9155 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
45 |
14 |
9338 |
441.6 |
-0.4 |
0.667 |
4 |
2 |
0 |
0.020 |
| Average: |
453.7 |
-0.8 |
0.653 |
4 |
2 |
0 |
0.020 |
| 4 |
12 |
|
E |
44 |
15 |
9376 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
52 |
16 |
9242 |
412.4 |
1.3 |
0.787 |
7 |
5 |
0 |
0.000 |
| 5 |
13 |
|
C |
27 |
8 |
9242 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
8 |
9155 |
274.5 |
-2.0 |
0.460 |
3 |
3 |
0 |
0.000 |
14 |
|
D |
24 |
8 |
9338 |
◊ |
B |
x-1,y,z |
1_455 |
30 |
7 |
9242 |
266.1 |
-2.0 |
0.443 |
3 |
4 |
0 |
0.000 |
| Average: |
270.3 |
-2.0 |
0.452 |
3 |
4 |
0 |
0.000 |
| 6 |
15 |
|
E |
28 |
9 |
9376 |
◊ |
F |
-x,y-1/2,-z-1/2 |
3_544 |
33 |
10 |
9335 |
235.7 |
-1.5 |
0.528 |
2 |
0 |
0 |
0.000 |
| 7 |
16 |
|
F |
13 |
8 |
9335 |
◊ |
A |
x,y,z |
1_555 |
14 |
8 |
9155 |
160.4 |
-5.3 |
0.019 |
0 |
0 |
0 |
0.041 |
17 |
|
D |
12 |
7 |
9338 |
◊ |
C |
x,y,z |
1_555 |
12 |
7 |
9242 |
150.8 |
-4.7 |
0.029 |
0 |
0 |
0 |
0.041 |
18 |
|
E |
13 |
7 |
9376 |
◊ |
B |
x,y,z |
1_555 |
12 |
8 |
9242 |
149.9 |
-5.1 |
0.020 |
0 |
0 |
0 |
0.041 |
| Average: |
153.7 |
-5.0 |
0.022 |
0 |
0 |
0 |
0.041 |
| 8 |
19 |
|
C |
18 |
7 |
9242 |
◊ |
F |
-x,y-1/2,-z-1/2 |
3_544 |
22 |
11 |
9335 |
157.7 |
-1.4 |
0.447 |
1 |
0 |
0 |
0.000 |
| 9 |
20 |
|
[GOL]B:177 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
9242 |
124.5 |
-0.3 |
0.552 |
1 |
0 |
0 |
0.007 |
| 10 |
21 |
|
[GOL]E:176 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
9376 |
107.4 |
0.0 |
0.579 |
3 |
0 |
0 |
0.015 |
| 11 |
22 |
|
A |
15 |
5 |
9155 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
11 |
5 |
9242 |
105.3 |
0.0 |
0.647 |
1 |
0 |
0 |
0.001 |
| 12 |
23 |
|
[GOL]C:176 |
5 |
1 |
219 |
f |
B |
-x+1/2,-y,z-1/2 |
2_554 |
14 |
4 |
9242 |
102.2 |
-1.4 |
0.367 |
1 |
0 |
0 |
0.017 |
| 13 |
24 |
|
[CL]B:175 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
9242 |
82.8 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.208 |
25 |
|
[CL]A:175 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
9155 |
80.9 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.208 |
| Average: |
81.9 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.208 |
| 14 |
26 |
|
[CL]C:175 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
9242 |
77.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
27 |
|
[CL]B:176 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
9242 |
77.6 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
28 |
|
[CL]A:174 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
9155 |
77.0 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.292 |
29 |
|
[CL]F:174 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
15 |
7 |
9335 |
77.0 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
30 |
|
[CL]D:174 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
17 |
8 |
9338 |
76.8 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
31 |
|
[CL]E:174 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
9376 |
76.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.292 |
| Average: |
77.1 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.292 |
| 15 |
32 |
|
[CL]C:174 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
9242 |
70.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.210 |
33 |
|
[CL]A:176 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
9155 |
68.1 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.210 |
34 |
|
[CL]E:175 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
9376 |
67.6 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.210 |
35 |
|
[CL]B:174 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
9242 |
64.8 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.210 |
36 |
|
[CL]F:175 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
13 |
7 |
9335 |
63.7 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.210 |
37 |
|
[CL]D:175 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
9338 |
59.9 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.210 |
| Average: |
65.7 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.210 |
| 16 |
38 |
|
[CL]C:173 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
14 |
5 |
9335 |
53.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
39 |
|
[CL]F:173 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
9242 |
52.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
40 |
|
[CL]B:173 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
9155 |
52.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
41 |
|
[CL]E:173 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
9338 |
51.7 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
42 |
|
[CL]A:173 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
9242 |
51.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
43 |
|
[CL]D:173 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
13 |
4 |
9376 |
50.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
| Average: |
51.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.170 |
| 17 |
44 |
|
D |
5 |
2 |
9338 |
◊ |
F |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
9335 |
52.8 |
1.0 |
0.782 |
0 |
0 |
0 |
0.000 |
| 18 |
45 |
|
[GOL]C:176 |
3 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
9242 |
47.5 |
-0.4 |
0.498 |
0 |
0 |
0 |
0.001 |
| 19 |
46 |
|
[CL]E:173 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
9376 |
45.1 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.137 |
47 |
|
[CL]B:173 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
9242 |
44.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
48 |
|
[CL]F:173 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
9 |
4 |
9335 |
44.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
49 |
|
[CL]A:173 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
9155 |
43.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
50 |
|
[CL]C:173 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
9242 |
43.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
51 |
|
[CL]D:173 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
9338 |
43.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
| Average: |
44.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.137 |
| 20 |
52 |
|
[GOL]E:176 |
4 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
9338 |
45.0 |
-0.6 |
0.389 |
0 |
0 |
0 |
0.007 |
| 21 |
53 |
|
E |
1 |
1 |
9376 |
◊ |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
3 |
1 |
9155 |
12.7 |
0.2 |
0.737 |
0 |
0 |
0 |
0.000 |
| 22 |
54 |
|
[CL]A:174 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9242 |
2.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
55 |
|
[CL]E:174 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
9338 |
1.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.003 |
| Average: |
2.0 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
|