| ## |
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 |
|
B |
122 |
30 |
17896 |
◊ |
A |
x,y,z |
1_555 |
123 |
30 |
18196 |
1181.3 |
-9.5 |
0.276 |
18 |
2 |
0 |
0.550 |
2 |
|
D |
123 |
30 |
17969 |
◊ |
C |
x,y,z |
1_555 |
121 |
31 |
17804 |
1181.0 |
-8.6 |
0.337 |
19 |
4 |
0 |
0.550 |
| Average: |
1181.1 |
-9.0 |
0.306 |
19 |
3 |
0 |
0.550 |
| 2 |
3 |
|
X |
43 |
10 |
1308 |
◊ |
B |
x,y,z |
1_555 |
64 |
21 |
17896 |
515.1 |
-9.5 |
0.586 |
3 |
0 |
0 |
0.849 |
4 |
|
Y |
40 |
10 |
1304 |
◊ |
C |
x,y,z |
1_555 |
58 |
20 |
17804 |
504.5 |
-10.3 |
0.472 |
3 |
0 |
0 |
0.849 |
| Average: |
509.8 |
-9.9 |
0.529 |
3 |
0 |
0 |
0.849 |
| 3 |
5 |
|
C |
32 |
9 |
17804 |
◊ |
A |
x-1,y,z+1 |
1_456 |
40 |
13 |
18196 |
333.0 |
-1.0 |
0.513 |
2 |
3 |
0 |
0.000 |
6 |
|
D |
33 |
11 |
17969 |
◊ |
B |
x-1,y-1,z |
1_445 |
30 |
8 |
17896 |
308.7 |
-0.6 |
0.568 |
2 |
2 |
0 |
0.000 |
| Average: |
320.8 |
-0.8 |
0.541 |
2 |
3 |
0 |
0.000 |
| 4 |
7 |
|
Y |
22 |
7 |
1304 |
◊ |
A |
x-1,y,z+1 |
1_456 |
40 |
13 |
18196 |
318.9 |
-6.2 |
0.580 |
0 |
0 |
0 |
0.269 |
8 |
|
D |
42 |
12 |
17969 |
◊ |
X |
x-1,y-1,z |
1_445 |
23 |
8 |
1308 |
305.7 |
-6.2 |
0.519 |
0 |
0 |
0 |
0.269 |
| Average: |
312.3 |
-6.2 |
0.550 |
0 |
0 |
0 |
0.269 |
| 5 |
9 |
|
A |
27 |
12 |
18196 |
◊ |
B |
x,y,z-1 |
1_554 |
26 |
12 |
17896 |
267.8 |
-1.4 |
0.465 |
3 |
3 |
0 |
0.000 |
10 |
|
D |
24 |
13 |
17969 |
◊ |
C |
x,y-1,z |
1_545 |
22 |
9 |
17804 |
214.9 |
-2.5 |
0.304 |
2 |
0 |
0 |
0.000 |
| Average: |
241.4 |
-2.0 |
0.384 |
3 |
2 |
0 |
0.000 |
| 6 |
11 |
|
[MPD]A:401 |
7 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
33 |
12 |
18196 |
192.1 |
-13.6 |
0.448 |
2 |
0 |
0 |
0.632 |
| 7 |
12 |
|
[MPD]D:401 |
7 |
1 |
279 |
f |
D |
x,y,z |
1_555 |
30 |
11 |
17969 |
190.8 |
-13.7 |
0.446 |
2 |
0 |
0 |
0.636 |
| 8 |
13 |
|
C |
21 |
11 |
17804 |
x |
C |
x,y,z-1 |
1_554 |
19 |
5 |
17804 |
160.8 |
0.5 |
0.701 |
1 |
2 |
0 |
0.000 |
14 |
|
B |
23 |
12 |
17896 |
x |
B |
x,y-1,z |
1_545 |
18 |
5 |
17896 |
151.7 |
-0.3 |
0.609 |
0 |
1 |
0 |
0.000 |
15 |
|
A |
12 |
3 |
18196 |
x |
A |
x,y-1,z |
1_545 |
12 |
7 |
18196 |
118.2 |
2.2 |
0.848 |
3 |
3 |
0 |
0.000 |
16 |
|
D |
12 |
4 |
17969 |
x |
D |
x,y,z-1 |
1_554 |
12 |
8 |
17969 |
117.0 |
1.9 |
0.829 |
3 |
3 |
0 |
0.000 |
| Average: |
136.9 |
1.1 |
0.747 |
2 |
2 |
0 |
0.000 |
| 9 |
17 |
|
D |
14 |
4 |
17969 |
◊ |
B |
x,y,z |
1_555 |
18 |
5 |
17896 |
148.4 |
2.7 |
0.875 |
5 |
3 |
0 |
0.000 |
| 10 |
18 |
|
A |
16 |
6 |
18196 |
◊ |
C |
x,y,z-1 |
1_554 |
17 |
4 |
17804 |
143.0 |
1.5 |
0.799 |
2 |
2 |
0 |
0.000 |
| 11 |
19 |
|
C |
10 |
5 |
17804 |
◊ |
B |
x-1,y,z |
1_455 |
9 |
5 |
17896 |
77.0 |
0.8 |
0.760 |
2 |
0 |
0 |
0.000 |
| 12 |
20 |
|
[ACE]Y:1 |
3 |
1 |
172 |
cf |
Y |
x,y,z |
1_555 |
5 |
2 |
1304 |
54.8 |
-1.0 |
0.812 |
0 |
0 |
0 |
0.100 |
| 13 |
21 |
|
[ACE]X:1 |
3 |
1 |
171 |
cf |
X |
x,y,z |
1_555 |
5 |
2 |
1308 |
54.0 |
-1.0 |
0.803 |
0 |
0 |
0 |
0.100 |
| 14 |
22 |
|
[ACE]Y:1 |
2 |
1 |
172 |
◊ |
A |
x-1,y,z+1 |
1_456 |
11 |
2 |
18196 |
51.5 |
-1.2 |
0.481 |
0 |
0 |
0 |
0.053 |
| 15 |
23 |
|
D |
10 |
2 |
17969 |
◊ |
[ACE]X:1 |
x-1,y-1,z |
1_445 |
2 |
1 |
171 |
50.9 |
-1.2 |
0.482 |
0 |
0 |
0 |
0.051 |
| 16 |
24 |
|
[ACE]X:1 |
3 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
17896 |
50.6 |
-0.6 |
0.578 |
1 |
0 |
0 |
0.082 |
| 17 |
25 |
|
[ACE]Y:1 |
3 |
1 |
172 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
17804 |
49.1 |
-0.6 |
0.586 |
1 |
0 |
0 |
0.075 |
| 18 |
26 |
|
D |
3 |
3 |
17969 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
18196 |
42.7 |
1.8 |
0.939 |
0 |
0 |
0 |
0.000 |
| 19 |
27 |
|
C |
2 |
1 |
17804 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
17896 |
18.3 |
0.7 |
0.818 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
D |
1 |
1 |
17969 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
17896 |
2.3 |
-0.1 |
0.421 |
0 |
0 |
0 |
0.000 |
|