## |
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 |
129 |
31 |
11536 |
◊ |
C |
x,y,z |
1_555 |
124 |
36 |
11561 |
1247.4 |
-17.1 |
0.095 |
14 |
7 |
0 |
0.416 |
2 |
|
E |
130 |
31 |
11476 |
◊ |
A |
x,y,z |
1_555 |
126 |
34 |
11272 |
1235.9 |
-16.7 |
0.138 |
15 |
7 |
0 |
0.416 |
3 |
|
C |
131 |
31 |
11561 |
◊ |
B |
x,y,z |
1_555 |
121 |
35 |
11089 |
1231.7 |
-16.6 |
0.113 |
15 |
7 |
0 |
0.416 |
4 |
|
F |
125 |
35 |
11601 |
◊ |
A |
x,y,z |
1_555 |
126 |
30 |
11272 |
1226.4 |
-16.3 |
0.153 |
15 |
7 |
0 |
0.416 |
5 |
|
D |
123 |
35 |
11536 |
◊ |
B |
x,y,z |
1_555 |
128 |
30 |
11089 |
1205.6 |
-17.2 |
0.114 |
13 |
7 |
0 |
0.416 |
6 |
|
F |
125 |
31 |
11601 |
◊ |
E |
x,y,z |
1_555 |
124 |
34 |
11476 |
1201.4 |
-17.2 |
0.105 |
13 |
7 |
0 |
0.416 |
Average: |
1224.7 |
-16.8 |
0.120 |
14 |
7 |
0 |
0.416 |
2 |
7 |
|
D |
97 |
24 |
11536 |
◊ |
A |
x,y,z |
1_555 |
95 |
24 |
11272 |
820.5 |
-1.0 |
0.837 |
15 |
6 |
0 |
0.067 |
8 |
|
E |
94 |
23 |
11476 |
◊ |
C |
x,y,z |
1_555 |
95 |
23 |
11561 |
810.1 |
-1.4 |
0.786 |
15 |
6 |
0 |
0.067 |
9 |
|
F |
93 |
22 |
11601 |
◊ |
B |
x,y,z |
1_555 |
92 |
22 |
11089 |
804.8 |
-1.5 |
0.809 |
17 |
6 |
0 |
0.067 |
Average: |
811.8 |
-1.3 |
0.811 |
16 |
6 |
0 |
0.067 |
3 |
10 |
|
E |
62 |
16 |
11476 |
◊ |
D |
x,y,z |
1_555 |
56 |
15 |
11536 |
473.1 |
-7.9 |
0.196 |
7 |
0 |
0 |
0.080 |
11 |
|
F |
60 |
16 |
11601 |
◊ |
C |
x,y,z |
1_555 |
61 |
16 |
11561 |
467.9 |
-8.0 |
0.188 |
7 |
0 |
0 |
0.080 |
12 |
|
B |
60 |
15 |
11089 |
◊ |
A |
x,y,z |
1_555 |
59 |
15 |
11272 |
461.6 |
-7.7 |
0.230 |
7 |
0 |
0 |
0.080 |
Average: |
467.5 |
-7.8 |
0.205 |
7 |
0 |
0 |
0.080 |
4 |
13 |
|
A |
41 |
17 |
11272 |
◊ |
D |
-y+1/2,x-1/2,z-1/4 |
3_544 |
38 |
12 |
11536 |
398.1 |
-3.6 |
0.461 |
5 |
4 |
0 |
0.000 |
5 |
14 |
|
F |
42 |
12 |
11601 |
◊ |
D |
-y+1/2,x-1/2,z-1/4 |
3_544 |
36 |
10 |
11536 |
334.3 |
-2.8 |
0.460 |
3 |
0 |
0 |
0.000 |
6 |
15 |
|
F |
29 |
8 |
11601 |
◊ |
E |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
34 |
12 |
11476 |
311.8 |
-3.4 |
0.415 |
6 |
4 |
0 |
0.000 |
7 |
16 |
|
E |
25 |
8 |
11476 |
◊ |
B |
-y-1/2,x-1/2,z-1/4 |
3_444 |
22 |
6 |
11089 |
217.1 |
1.2 |
0.824 |
3 |
4 |
0 |
0.000 |
8 |
17 |
|
C |
27 |
9 |
11561 |
◊ |
D |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
22 |
7 |
11536 |
204.1 |
1.7 |
0.850 |
4 |
4 |
0 |
0.000 |
9 |
18 |
|
[EDO]A:303 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
17 |
9 |
11601 |
96.3 |
2.3 |
0.537 |
2 |
0 |
0 |
0.000 |
19 |
|
[EDO]D:303 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
11561 |
96.1 |
2.4 |
0.533 |
2 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:303 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
17 |
9 |
11536 |
95.1 |
2.3 |
0.538 |
2 |
0 |
0 |
0.000 |
21 |
|
[EDO]F:303 |
4 |
1 |
182 |
f |
E |
x,y,z |
1_555 |
17 |
9 |
11476 |
94.9 |
2.4 |
0.541 |
2 |
0 |
0 |
0.000 |
22 |
|
[EDO]E:303 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
11272 |
94.2 |
2.3 |
0.542 |
2 |
0 |
0 |
0.000 |
Average: |
95.3 |
2.3 |
0.538 |
2 |
0 |
0 |
0.000 |
10 |
23 |
|
[EDO]C:303 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
11089 |
93.8 |
2.3 |
0.538 |
2 |
0 |
0 |
0.000 |
11 |
24 |
|
[IOD]E:310 |
1 |
1 |
144 |
f |
E |
x,y,z |
1_555 |
21 |
6 |
11476 |
88.6 |
-0.5 |
0.732 |
0 |
0 |
0 |
0.003 |
12 |
25 |
|
[EDO]B:303 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
11089 |
79.3 |
2.9 |
0.583 |
2 |
0 |
0 |
0.000 |
26 |
|
[EDO]D:303 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
12 |
3 |
11536 |
78.7 |
3.0 |
0.585 |
2 |
0 |
0 |
0.000 |
27 |
|
[EDO]E:303 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
11 |
3 |
11476 |
78.4 |
2.9 |
0.583 |
2 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:303 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
11272 |
78.2 |
2.9 |
0.585 |
2 |
0 |
0 |
0.000 |
Average: |
78.6 |
2.9 |
0.584 |
2 |
0 |
0 |
0.000 |
13 |
29 |
|
[EDO]C:303 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
11561 |
78.9 |
3.0 |
0.580 |
2 |
0 |
0 |
0.000 |
30 |
|
[EDO]F:303 |
4 |
1 |
182 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
11601 |
77.6 |
3.0 |
0.588 |
2 |
0 |
0 |
0.000 |
Average: |
78.2 |
3.0 |
0.584 |
2 |
0 |
0 |
0.000 |
14 |
31 |
|
[EDO]F:304 |
4 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
7 |
5 |
11601 |
71.5 |
2.6 |
0.964 |
2 |
0 |
0 |
0.000 |
15 |
32 |
|
[TRS]A:302 |
7 |
1 |
249 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
11272 |
69.4 |
2.0 |
0.077 |
2 |
0 |
0 |
0.000 |
33 |
|
[TRS]B:302 |
5 |
1 |
250 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
11089 |
54.0 |
1.3 |
0.134 |
2 |
0 |
0 |
0.000 |
Average: |
61.7 |
1.6 |
0.106 |
2 |
0 |
0 |
0.000 |
16 |
34 |
|
[TRS]A:302 |
7 |
1 |
249 |
◊ |
E |
x,y,z |
1_555 |
10 |
3 |
11476 |
67.8 |
1.9 |
0.060 |
2 |
0 |
0 |
0.000 |
35 |
|
[TRS]B:302 |
7 |
1 |
250 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
11561 |
67.1 |
1.9 |
0.060 |
2 |
0 |
0 |
0.000 |
Average: |
67.5 |
1.9 |
0.060 |
2 |
0 |
0 |
0.000 |
17 |
36 |
|
[TRS]B:302 |
7 |
1 |
250 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
11536 |
67.5 |
1.8 |
0.060 |
2 |
0 |
0 |
0.000 |
37 |
|
[TRS]A:302 |
5 |
1 |
249 |
f |
F |
x,y,z |
1_555 |
9 |
3 |
11601 |
52.5 |
1.2 |
0.105 |
2 |
0 |
0 |
0.000 |
Average: |
60.0 |
1.5 |
0.082 |
2 |
0 |
0 |
0.000 |
18 |
38 |
|
[IOD]F:310 |
1 |
1 |
144 |
f |
F |
x,y,z |
1_555 |
11 |
4 |
11601 |
65.4 |
-0.1 |
0.771 |
0 |
0 |
0 |
0.000 |
19 |
39 |
|
[EDO]F:304 |
4 |
1 |
185 |
f |
E |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
9 |
4 |
11476 |
50.3 |
1.6 |
0.779 |
0 |
0 |
0 |
0.000 |
20 |
40 |
|
[ZN]E:301 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
5 |
4 |
11476 |
49.7 |
-39.4 |
0.000 |
0 |
0 |
0 |
0.665 |
41 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
11089 |
49.7 |
-38.4 |
0.000 |
0 |
0 |
0 |
0.665 |
42 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
4 |
4 |
11561 |
49.5 |
-38.3 |
0.000 |
0 |
0 |
0 |
0.665 |
43 |
|
[ZN]F:301 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
4 |
4 |
11601 |
49.5 |
-38.3 |
0.000 |
0 |
0 |
0 |
0.665 |
44 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
11272 |
49.3 |
-38.2 |
0.000 |
0 |
0 |
0 |
0.665 |
45 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
11536 |
49.3 |
-38.3 |
0.000 |
0 |
0 |
0 |
0.665 |
Average: |
49.5 |
-38.5 |
0.000 |
0 |
0 |
0 |
0.665 |
21 |
46 |
|
E |
5 |
2 |
11476 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11089 |
36.9 |
-1.0 |
0.306 |
0 |
0 |
0 |
0.007 |
47 |
|
C |
5 |
2 |
11561 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
11272 |
36.4 |
-1.0 |
0.307 |
0 |
0 |
0 |
0.007 |
48 |
|
F |
5 |
2 |
11601 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
11536 |
35.2 |
-1.0 |
0.282 |
0 |
0 |
0 |
0.007 |
Average: |
36.2 |
-1.0 |
0.299 |
0 |
0 |
0 |
0.007 |
22 |
49 |
|
[IOD]F:310 |
1 |
1 |
144 |
◊ |
E |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
3 |
2 |
11476 |
33.0 |
0.8 |
0.975 |
0 |
0 |
0 |
0.000 |
23 |
50 |
|
C |
2 |
2 |
11561 |
◊ |
A |
y,x-1,-z |
7_545 |
4 |
2 |
11272 |
23.4 |
-1.1 |
0.163 |
0 |
0 |
0 |
0.000 |
|