| ## |
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 |
324 |
93 |
23745 |
◊ |
A |
x,y,z |
1_555 |
310 |
89 |
22461 |
3183.1 |
-34.7 |
0.051 |
40 |
22 |
0 |
0.641 |
2 |
|
C |
327 |
91 |
23708 |
◊ |
B |
x,y,z |
1_555 |
294 |
85 |
22444 |
3133.3 |
-32.5 |
0.064 |
44 |
19 |
0 |
0.641 |
| Average: |
3158.2 |
-33.6 |
0.057 |
42 |
21 |
0 |
0.641 |
| 2 |
3 |
|
C |
161 |
44 |
23708 |
◊ |
A |
x,y,z |
1_555 |
158 |
46 |
22461 |
1538.0 |
-1.9 |
0.757 |
38 |
0 |
0 |
0.361 |
4 |
|
D |
168 |
44 |
23745 |
◊ |
B |
x,y,z |
1_555 |
151 |
45 |
22444 |
1528.6 |
-2.1 |
0.748 |
41 |
0 |
0 |
0.361 |
| Average: |
1533.3 |
-2.0 |
0.752 |
40 |
0 |
0 |
0.361 |
| 3 |
5 |
|
D |
83 |
24 |
23745 |
◊ |
C |
x,y,z |
1_555 |
82 |
23 |
23708 |
794.6 |
-8.8 |
0.230 |
8 |
2 |
0 |
0.056 |
| 4 |
6 |
|
B |
66 |
19 |
22444 |
◊ |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
62 |
18 |
23745 |
635.1 |
3.6 |
0.914 |
13 |
6 |
0 |
0.000 |
| 5 |
7 |
|
B |
51 |
14 |
22444 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
49 |
13 |
22461 |
441.9 |
-0.6 |
0.697 |
5 |
0 |
0 |
0.000 |
| 6 |
8 |
|
B |
56 |
19 |
22444 |
◊ |
A |
x,y,z |
1_555 |
58 |
18 |
22461 |
441.1 |
1.7 |
0.852 |
4 |
6 |
0 |
0.004 |
| 7 |
9 |
|
C |
46 |
15 |
23708 |
◊ |
D |
x-1,y,z |
1_455 |
45 |
13 |
23745 |
422.7 |
4.9 |
0.955 |
7 |
13 |
0 |
0.000 |
| 8 |
10 |
|
[TDP]A:602 |
23 |
1 |
595 |
f |
A |
x,y,z |
1_555 |
40 |
20 |
22461 |
312.1 |
-7.3 |
0.229 |
8 |
0 |
0 |
0.206 |
| 9 |
11 |
|
[TDP]D:601 |
26 |
1 |
595 |
f |
D |
x,y,z |
1_555 |
46 |
20 |
23745 |
307.1 |
-4.6 |
0.363 |
10 |
0 |
0 |
0.172 |
12 |
|
[TDP]C:601 |
26 |
1 |
598 |
f |
C |
x,y,z |
1_555 |
48 |
22 |
23708 |
306.9 |
-5.1 |
0.360 |
9 |
0 |
0 |
0.172 |
| Average: |
307.0 |
-4.9 |
0.361 |
10 |
0 |
0 |
0.172 |
| 10 |
13 |
|
[TDP]B:601 |
24 |
1 |
593 |
f |
B |
x,y,z |
1_555 |
38 |
18 |
22444 |
299.3 |
-6.3 |
0.271 |
9 |
0 |
0 |
0.183 |
| 11 |
14 |
|
B |
31 |
10 |
22444 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
27 |
11 |
23708 |
272.7 |
-3.2 |
0.184 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
D |
19 |
6 |
23745 |
◊ |
A |
-x+3/2,-y,z-1/2 |
2_654 |
23 |
7 |
22461 |
196.1 |
-2.7 |
0.301 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
C |
23 |
6 |
23708 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
6 |
22461 |
194.7 |
0.1 |
0.706 |
1 |
0 |
0 |
0.000 |
17 |
|
B |
7 |
2 |
22444 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
23745 |
84.6 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
| Average: |
139.6 |
0.1 |
0.682 |
1 |
0 |
0 |
0.000 |
| 14 |
18 |
|
C |
19 |
8 |
23708 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
17 |
5 |
23745 |
150.8 |
0.3 |
0.718 |
1 |
2 |
0 |
0.000 |
| 15 |
19 |
|
[TDP]C:601 |
13 |
1 |
598 |
◊ |
B |
x,y,z |
1_555 |
24 |
11 |
22444 |
148.8 |
2.8 |
0.778 |
1 |
0 |
0 |
0.000 |
20 |
|
[TDP]D:601 |
13 |
1 |
595 |
◊ |
A |
x,y,z |
1_555 |
23 |
11 |
22461 |
146.0 |
2.7 |
0.768 |
1 |
0 |
0 |
0.000 |
| Average: |
147.4 |
2.8 |
0.773 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[TDP]A:602 |
11 |
1 |
595 |
◊ |
D |
x,y,z |
1_555 |
18 |
7 |
23745 |
118.7 |
1.7 |
0.551 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[TDP]B:601 |
10 |
1 |
593 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
23708 |
113.2 |
1.7 |
0.548 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
C |
11 |
4 |
23708 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
4 |
22461 |
76.4 |
-0.6 |
0.470 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[MN]B:602 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
22444 |
50.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.155 |
25 |
|
[MN]D:602 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
12 |
8 |
23745 |
50.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.155 |
26 |
|
[MN]A:601 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
22461 |
49.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.155 |
27 |
|
[MN]C:602 |
1 |
1 |
123 |
cf |
C |
x,y,z |
1_555 |
13 |
8 |
23708 |
48.6 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.155 |
| Average: |
49.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.155 |
| 20 |
28 |
|
[TDP]A:602 |
6 |
1 |
595 |
cf |
[MN]A:601 |
x,y,z |
1_555 |
1 |
1 |
123 |
41.3 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.076 |
29 |
|
[TDP]B:601 |
5 |
1 |
593 |
f |
[MN]B:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
41.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.076 |
| Average: |
41.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.076 |
| 21 |
30 |
|
[TDP]D:601 |
4 |
1 |
595 |
cf |
[MN]D:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
39.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.072 |
31 |
|
[TDP]C:601 |
5 |
1 |
598 |
cf |
[MN]C:602 |
x,y,z |
1_555 |
1 |
1 |
123 |
38.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.072 |
| Average: |
38.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.072 |
| 22 |
32 |
|
D |
1 |
1 |
23745 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
22461 |
8.6 |
0.0 |
0.565 |
0 |
0 |
0 |
0.000 |
|