| ## |
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 |
287 |
74 |
21852 |
◊ |
A |
x,y,z |
1_555 |
310 |
84 |
28577 |
2825.4 |
-24.5 |
0.207 |
38 |
7 |
0 |
0.718 |
2 |
|
D |
292 |
75 |
21541 |
◊ |
C |
x,y,z |
1_555 |
310 |
85 |
28944 |
2808.6 |
-27.2 |
0.154 |
34 |
7 |
0 |
0.718 |
| Average: |
2817.0 |
-25.8 |
0.180 |
36 |
7 |
0 |
0.718 |
| 2 |
3 |
|
F |
194 |
23 |
7368 |
◊ |
C |
x,y,z |
1_555 |
227 |
69 |
28944 |
1805.7 |
-15.0 |
0.439 |
23 |
0 |
0 |
0.692 |
| 3 |
4 |
|
E |
191 |
23 |
6812 |
◊ |
A |
x,y,z |
1_555 |
221 |
69 |
28577 |
1788.4 |
-15.6 |
0.490 |
18 |
0 |
0 |
0.682 |
| 4 |
5 |
|
C |
78 |
26 |
28944 |
◊ |
A |
x,y,z |
1_555 |
76 |
27 |
28577 |
756.6 |
-9.1 |
0.188 |
5 |
2 |
0 |
0.000 |
| 5 |
6 |
|
D |
76 |
19 |
21541 |
x |
D |
-x+y+5/3,-x+7/3,z+1/3 |
6_675 |
66 |
20 |
21541 |
613.9 |
-8.1 |
0.194 |
2 |
1 |
0 |
0.000 |
| 6 |
7 |
|
[DGT]A:601 |
29 |
1 |
595 |
f |
A |
x,y,z |
1_555 |
47 |
17 |
28577 |
341.7 |
0.5 |
0.599 |
6 |
0 |
0 |
0.103 |
8 |
|
[DGT]F:701 |
29 |
1 |
588 |
f |
C |
x,y,z |
1_555 |
48 |
17 |
28944 |
332.0 |
-1.1 |
0.542 |
6 |
0 |
0 |
0.103 |
| Average: |
336.9 |
-0.3 |
0.570 |
6 |
0 |
0 |
0.103 |
| 7 |
9 |
|
B |
31 |
11 |
21852 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
36 |
11 |
28577 |
299.8 |
0.3 |
0.714 |
2 |
1 |
0 |
0.000 |
| 8 |
10 |
|
A |
35 |
9 |
28577 |
x |
A |
x,y,z-1 |
1_554 |
34 |
9 |
28577 |
262.7 |
-2.4 |
0.412 |
2 |
0 |
0 |
0.000 |
| 9 |
11 |
|
F |
21 |
3 |
7368 |
◊ |
A |
x,y,z-1 |
1_554 |
39 |
12 |
28577 |
245.6 |
-3.1 |
0.497 |
4 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[OMC]E:4 |
20 |
1 |
466 |
cf |
E |
x,y,z |
1_555 |
33 |
5 |
6812 |
240.3 |
4.2 |
0.845 |
4 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[OMC]F:4 |
20 |
1 |
467 |
cf |
F |
x,y,z |
1_555 |
33 |
5 |
7368 |
240.1 |
4.3 |
0.831 |
4 |
0 |
0 |
0.000 |
| 12 |
14 |
|
C |
30 |
9 |
28944 |
◊ |
A |
-y+8/3,x-y+4/3,z-2/3 |
5_764 |
25 |
8 |
28577 |
239.7 |
0.1 |
0.699 |
4 |
1 |
0 |
0.000 |
| 13 |
15 |
|
[OMC]F:2 |
20 |
1 |
464 |
cf |
F |
x,y,z |
1_555 |
31 |
4 |
7368 |
234.5 |
3.3 |
0.811 |
3 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[OMC]E:2 |
20 |
1 |
459 |
cf |
E |
x,y,z |
1_555 |
31 |
4 |
6812 |
233.4 |
3.3 |
0.828 |
3 |
0 |
0 |
0.000 |
| 15 |
17 |
|
D |
24 |
8 |
21541 |
◊ |
A |
-x+y+5/3,-x+7/3,z-2/3 |
6_674 |
20 |
6 |
28577 |
207.9 |
-1.9 |
0.381 |
2 |
0 |
0 |
0.000 |
| 16 |
18 |
|
B |
21 |
6 |
21852 |
◊ |
E |
-y+2,x-y+1,z |
2_765 |
25 |
4 |
6812 |
190.4 |
-5.4 |
0.320 |
5 |
0 |
0 |
0.000 |
| 17 |
19 |
|
E |
21 |
6 |
6812 |
◊ |
B |
x,y,z |
1_555 |
22 |
9 |
21852 |
167.9 |
-4.7 |
0.397 |
1 |
0 |
0 |
0.060 |
| 18 |
20 |
|
[DGT]A:601 |
18 |
1 |
595 |
◊ |
E |
x,y,z |
1_555 |
23 |
3 |
6812 |
163.5 |
2.7 |
0.779 |
3 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[OMC]F:2 |
14 |
1 |
464 |
◊ |
C |
x,y,z |
1_555 |
20 |
8 |
28944 |
161.2 |
-1.8 |
0.383 |
1 |
0 |
0 |
0.077 |
22 |
|
[OMC]E:2 |
13 |
1 |
459 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
28577 |
160.2 |
-2.2 |
0.356 |
1 |
0 |
0 |
0.077 |
| Average: |
160.7 |
-2.0 |
0.369 |
1 |
0 |
0 |
0.077 |
| 20 |
23 |
|
[DGT]F:701 |
17 |
1 |
588 |
◊ |
F |
x,y,z |
1_555 |
25 |
3 |
7368 |
158.6 |
2.7 |
0.780 |
3 |
0 |
0 |
0.000 |
| 21 |
24 |
|
C |
19 |
5 |
28944 |
◊ |
B |
-y+8/3,x-y+4/3,z-2/3 |
5_764 |
20 |
5 |
21852 |
155.9 |
2.4 |
0.890 |
3 |
3 |
0 |
0.000 |
| 22 |
25 |
|
C |
18 |
5 |
28944 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
5 |
28577 |
125.9 |
-2.0 |
0.346 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
F |
19 |
6 |
7368 |
◊ |
D |
x,y,z |
1_555 |
18 |
8 |
21541 |
117.6 |
-5.1 |
0.303 |
0 |
0 |
0 |
0.058 |
| 24 |
27 |
|
[GOL]B:701 |
5 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
28577 |
114.5 |
-0.3 |
0.551 |
2 |
0 |
0 |
0.035 |
| 25 |
28 |
|
[GOL]D:601 |
6 |
1 |
221 |
◊ |
C |
x,y,z |
1_555 |
24 |
10 |
28944 |
112.2 |
-0.2 |
0.598 |
1 |
0 |
0 |
0.011 |
| 26 |
29 |
|
[GOL]D:602 |
6 |
1 |
219 |
◊ |
D |
x,y,z |
1_555 |
15 |
7 |
21541 |
109.7 |
-0.2 |
0.589 |
2 |
0 |
0 |
0.018 |
| 27 |
30 |
|
[GOL]B:702 |
6 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
21852 |
108.0 |
-0.2 |
0.615 |
2 |
0 |
0 |
0.019 |
| 28 |
31 |
|
B |
11 |
2 |
21852 |
◊ |
C |
-y+2,x-y+1,z |
2_765 |
18 |
4 |
28944 |
94.6 |
-1.1 |
0.445 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
D |
8 |
4 |
21541 |
◊ |
F |
-x+y+5/3,-x+7/3,z+1/3 |
6_675 |
13 |
4 |
7368 |
93.2 |
-1.6 |
0.517 |
1 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[OMC]E:4 |
12 |
1 |
466 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
28577 |
88.0 |
0.3 |
0.492 |
0 |
0 |
0 |
0.000 |
34 |
|
[OMC]F:4 |
12 |
1 |
467 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
28944 |
87.7 |
0.2 |
0.484 |
0 |
0 |
0 |
0.000 |
| Average: |
87.9 |
0.2 |
0.488 |
0 |
0 |
0 |
0.000 |
| 31 |
35 |
|
[GOL]B:702 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
28577 |
87.4 |
-1.2 |
0.354 |
0 |
0 |
0 |
0.036 |
| 32 |
36 |
|
[GOL]D:602 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
28944 |
85.7 |
-1.3 |
0.288 |
0 |
0 |
0 |
0.037 |
| 33 |
37 |
|
D |
9 |
4 |
21541 |
◊ |
C |
-x+y+5/3,-x+7/3,z-2/3 |
6_674 |
8 |
3 |
28944 |
81.7 |
-0.4 |
0.525 |
1 |
1 |
0 |
0.000 |
| 34 |
38 |
|
[GOL]D:601 |
5 |
1 |
221 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
21541 |
66.3 |
-0.2 |
0.490 |
2 |
0 |
0 |
0.100 |
| 35 |
39 |
|
[GOL]B:701 |
6 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
21852 |
62.6 |
-0.1 |
0.506 |
2 |
0 |
0 |
0.017 |
| 36 |
40 |
|
D |
5 |
1 |
21541 |
◊ |
E |
-x+y+5/3,-x+7/3,z-2/3 |
6_674 |
12 |
1 |
6812 |
60.0 |
0.9 |
0.774 |
1 |
0 |
0 |
0.000 |
| 37 |
41 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
28944 |
37.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.167 |
42 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
28577 |
37.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.167 |
| Average: |
37.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.167 |
| 38 |
43 |
|
B |
8 |
3 |
21852 |
◊ |
A |
x,y,z-1 |
1_554 |
4 |
3 |
28577 |
36.6 |
0.9 |
0.732 |
0 |
0 |
0 |
0.000 |
| 39 |
44 |
|
C |
3 |
1 |
28944 |
◊ |
D |
-x+y+5/3,-x+7/3,z+1/3 |
6_675 |
2 |
1 |
21541 |
34.8 |
0.0 |
0.487 |
0 |
1 |
0 |
0.000 |
| 40 |
45 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
[DGT]F:701 |
x,y,z |
1_555 |
9 |
1 |
588 |
33.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.118 |
46 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
[DGT]A:601 |
x,y,z |
1_555 |
8 |
1 |
595 |
32.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.118 |
| Average: |
32.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.118 |
| 41 |
47 |
|
[OMC]F:4 |
3 |
1 |
467 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
21541 |
32.7 |
-1.0 |
0.393 |
1 |
0 |
0 |
0.019 |
48 |
|
[OMC]E:4 |
3 |
1 |
466 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
21852 |
31.4 |
-1.2 |
0.352 |
1 |
0 |
0 |
0.019 |
| Average: |
32.1 |
-1.1 |
0.373 |
1 |
0 |
0 |
0.019 |
| 42 |
49 |
|
D |
5 |
4 |
21541 |
◊ |
B |
-y+8/3,x-y+4/3,z-2/3 |
5_764 |
5 |
2 |
21852 |
23.3 |
0.0 |
0.647 |
0 |
0 |
0 |
0.000 |
| 43 |
50 |
|
D |
1 |
1 |
21541 |
x |
D |
-x+y+5/3,-x+7/3,z-2/3 |
6_674 |
2 |
2 |
21541 |
15.7 |
0.4 |
0.512 |
0 |
0 |
0 |
0.000 |
| 44 |
51 |
|
[OMC]E:4 |
2 |
1 |
466 |
◊ |
[GOL]B:702 |
x,y,z |
1_555 |
2 |
1 |
218 |
5.7 |
0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
| 45 |
52 |
|
[OMC]F:4 |
2 |
1 |
467 |
◊ |
[GOL]D:602 |
x,y,z |
1_555 |
2 |
1 |
219 |
3.6 |
0.1 |
0.516 |
0 |
0 |
0 |
0.000 |
|