| ## |
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 |
171 |
49 |
7295 |
◊ |
B |
x,y,z |
1_555 |
166 |
47 |
7380 |
1507.3 |
-18.5 |
0.457 |
7 |
2 |
0 |
1.000 |
| 2 |
2 |
|
B |
71 |
19 |
7380 |
◊ |
B |
-x+1,y,-z |
3_655 |
70 |
19 |
7380 |
619.6 |
-8.7 |
0.414 |
2 |
0 |
0 |
0.164 |
| 3 |
3 |
|
D |
38 |
11 |
7295 |
◊ |
B |
x,-y,-z |
4_555 |
38 |
11 |
7380 |
426.5 |
-9.7 |
0.064 |
1 |
0 |
0 |
0.455 |
| 4 |
4 |
|
P |
38 |
7 |
1115 |
◊ |
D |
x,y,z |
1_555 |
53 |
17 |
7295 |
387.4 |
-5.5 |
0.561 |
0 |
0 |
0 |
0.247 |
| 5 |
5 |
|
M |
34 |
6 |
1155 |
◊ |
B |
x,y,z |
1_555 |
52 |
19 |
7380 |
378.7 |
-5.3 |
0.590 |
1 |
0 |
0 |
0.258 |
| 6 |
6 |
|
B |
23 |
4 |
7380 |
◊ |
D |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
30 |
12 |
7295 |
250.8 |
-0.8 |
0.640 |
2 |
0 |
0 |
0.000 |
| 7 |
7 |
|
D |
17 |
4 |
7295 |
◊ |
D |
-x,y,-z |
3_555 |
17 |
4 |
7295 |
201.4 |
-4.0 |
0.193 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
B |
17 |
5 |
7380 |
◊ |
B |
x,-y,-z |
4_555 |
17 |
5 |
7380 |
161.9 |
0.2 |
0.782 |
0 |
0 |
0 |
0.000 |
9 |
|
D |
18 |
6 |
7295 |
◊ |
D |
x,-y,-z |
4_555 |
18 |
6 |
7295 |
156.9 |
-0.1 |
0.746 |
0 |
0 |
0 |
0.000 |
| Average: |
159.4 |
0.0 |
0.764 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
D |
18 |
7 |
7295 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
16 |
6 |
7380 |
140.1 |
-2.0 |
0.475 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
P |
14 |
3 |
1115 |
◊ |
P |
x,-y,-z+1 |
4_556 |
14 |
3 |
1115 |
125.3 |
-3.0 |
0.498 |
0 |
0 |
0 |
0.006 |
| 11 |
12 |
|
[LEA]M:2 |
6 |
1 |
254 |
cf |
M |
x,y,z |
1_555 |
10 |
4 |
1155 |
120.6 |
2.3 |
0.059 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
P |
17 |
4 |
1115 |
◊ |
B |
x,-y,-z |
4_555 |
14 |
3 |
7380 |
117.0 |
-2.9 |
0.399 |
0 |
0 |
0 |
0.254 |
14 |
|
M |
16 |
4 |
1155 |
◊ |
D |
x,-y,-z |
4_555 |
13 |
2 |
7295 |
112.8 |
-2.7 |
0.385 |
0 |
0 |
0 |
0.254 |
| Average: |
114.9 |
-2.8 |
0.392 |
0 |
0 |
0 |
0.254 |
| 13 |
15 |
|
[LEA]P:2 |
6 |
1 |
249 |
cf |
P |
x,y,z |
1_555 |
11 |
4 |
1115 |
109.8 |
2.2 |
0.033 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
M |
12 |
4 |
1155 |
◊ |
B |
-x+1,y,-z |
3_655 |
10 |
3 |
7380 |
82.5 |
-1.5 |
0.548 |
0 |
0 |
0 |
0.051 |
| 15 |
17 |
|
D |
5 |
3 |
7295 |
◊ |
B |
x,-y,-z+1 |
4_556 |
6 |
2 |
7380 |
66.2 |
-0.6 |
0.443 |
0 |
0 |
0 |
0.002 |
| 16 |
18 |
|
B |
10 |
4 |
7380 |
◊ |
B |
x,-y,-z+1 |
4_556 |
10 |
4 |
7380 |
54.2 |
-0.0 |
0.715 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
P |
7 |
2 |
1115 |
◊ |
D |
x,-y,-z+1 |
4_556 |
4 |
3 |
7295 |
52.5 |
-1.1 |
0.335 |
0 |
0 |
0 |
0.004 |
| 18 |
20 |
|
[NH2]M:10 |
1 |
1 |
117 |
cf |
M |
x,y,z |
1_555 |
4 |
1 |
1155 |
51.8 |
0.3 |
0.723 |
0 |
0 |
0 |
0.000 |
21 |
|
[NH2]P:10 |
1 |
1 |
117 |
cf |
P |
x,y,z |
1_555 |
6 |
2 |
1115 |
47.7 |
0.2 |
0.764 |
0 |
0 |
0 |
0.000 |
| Average: |
49.7 |
0.2 |
0.743 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
D |
6 |
2 |
7295 |
x |
D |
x,y,z-1 |
1_554 |
5 |
3 |
7295 |
48.8 |
-0.9 |
0.406 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[NH2]P:10 |
1 |
1 |
117 |
◊ |
D |
x,-y,-z+1 |
4_556 |
3 |
1 |
7295 |
39.3 |
-0.0 |
0.460 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[LEA]P:2 |
5 |
1 |
249 |
◊ |
[LEA]P:2 |
x,-y,-z+1 |
4_556 |
5 |
1 |
249 |
36.0 |
2.3 |
1.000 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
D |
6 |
2 |
7295 |
◊ |
B |
-x+1,-y,z |
2_655 |
3 |
2 |
7380 |
34.8 |
-0.8 |
0.374 |
0 |
0 |
0 |
0.026 |
| 23 |
26 |
|
[LEA]P:2 |
2 |
1 |
249 |
◊ |
P |
x,-y,-z+1 |
4_556 |
2 |
1 |
1115 |
26.3 |
-0.1 |
0.044 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
D |
2 |
1 |
7295 |
x |
D |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
7295 |
22.8 |
0.5 |
0.878 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
M |
5 |
1 |
1155 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
2 |
7380 |
19.0 |
-0.4 |
0.431 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
B |
3 |
2 |
7380 |
◊ |
D |
x,y,z-1 |
1_554 |
2 |
1 |
7295 |
14.8 |
0.8 |
0.879 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[LEA]P:2 |
2 |
1 |
249 |
◊ |
D |
x,-y,-z+1 |
4_556 |
2 |
1 |
7295 |
14.5 |
1.0 |
0.971 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
B |
2 |
1 |
7380 |
x |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
7380 |
13.1 |
0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[NH2]P:10 |
1 |
1 |
117 |
◊ |
P |
x,-y,-z+1 |
4_556 |
3 |
2 |
1115 |
11.8 |
-0.1 |
0.789 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
P |
1 |
1 |
1115 |
◊ |
P |
-x,y,-z+1 |
3_556 |
1 |
1 |
1115 |
8.0 |
0.6 |
0.905 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
P |
1 |
1 |
1115 |
◊ |
P |
-x,-y,z |
2_555 |
1 |
1 |
1115 |
7.9 |
0.6 |
0.897 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[NH2]M:10 |
1 |
1 |
117 |
◊ |
B |
-x+1,y,-z |
3_655 |
4 |
2 |
7380 |
6.2 |
0.0 |
0.777 |
0 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[LEA]M:2 |
1 |
1 |
254 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7380 |
3.7 |
0.2 |
0.912 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[LEA]P:2 |
1 |
1 |
249 |
◊ |
B |
x,-y,-z |
4_555 |
1 |
1 |
7380 |
1.2 |
0.0 |
0.698 |
0 |
0 |
0 |
0.000 |
|