| ## |
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 |
|
E |
142 |
34 |
12564 |
◊ |
A |
x,y,z |
1_555 |
170 |
47 |
17896 |
1521.1 |
-19.4 |
0.114 |
20 |
4 |
0 |
0.428 |
| 2 |
2 |
|
D |
146 |
39 |
16811 |
◊ |
C |
x,y,z |
1_555 |
143 |
36 |
17769 |
1330.8 |
-10.0 |
0.264 |
12 |
5 |
0 |
0.265 |
3 |
|
B |
135 |
38 |
16662 |
◊ |
A |
x,y,z |
1_555 |
131 |
34 |
17896 |
1209.7 |
-8.3 |
0.278 |
15 |
8 |
0 |
0.265 |
| Average: |
1270.2 |
-9.2 |
0.271 |
14 |
7 |
0 |
0.265 |
| 3 |
4 |
|
F |
109 |
36 |
16748 |
◊ |
A |
x,y,z |
1_555 |
105 |
23 |
17896 |
955.5 |
1.7 |
0.770 |
14 |
5 |
0 |
0.000 |
| 4 |
5 |
|
B |
91 |
23 |
16662 |
◊ |
C |
x,y,z |
1_555 |
105 |
28 |
17769 |
869.0 |
-10.4 |
0.113 |
12 |
2 |
0 |
0.244 |
| 5 |
6 |
|
E |
81 |
16 |
12564 |
◊ |
C |
x,y,z |
1_555 |
80 |
23 |
17769 |
788.5 |
-8.8 |
0.204 |
7 |
4 |
0 |
0.157 |
| 6 |
7 |
|
D |
83 |
21 |
16811 |
◊ |
F |
-x,y-1/2,-z+1/2 |
4_545 |
79 |
23 |
16748 |
746.7 |
4.0 |
0.792 |
13 |
2 |
0 |
0.000 |
| 7 |
8 |
|
E |
59 |
17 |
12564 |
◊ |
D |
x,y,z |
1_555 |
82 |
22 |
16811 |
656.6 |
-3.9 |
0.516 |
6 |
4 |
0 |
0.089 |
| 8 |
9 |
|
E |
62 |
16 |
12564 |
◊ |
B |
x,y,z |
1_555 |
84 |
21 |
16662 |
656.3 |
-3.6 |
0.523 |
3 |
3 |
0 |
0.067 |
| 9 |
10 |
|
C |
65 |
19 |
17769 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
48 |
13 |
12564 |
549.2 |
-2.0 |
0.576 |
8 |
4 |
0 |
0.000 |
| 10 |
11 |
|
F |
49 |
14 |
16748 |
◊ |
B |
x,y,z |
1_555 |
42 |
11 |
16662 |
465.3 |
2.1 |
0.767 |
7 |
2 |
0 |
0.000 |
| 11 |
12 |
|
[GTP]A:501 |
32 |
1 |
625 |
f |
A |
x,y,z |
1_555 |
62 |
29 |
17896 |
408.8 |
-2.5 |
0.579 |
22 |
0 |
0 |
0.193 |
13 |
|
[GTP]C:501 |
32 |
1 |
627 |
f |
C |
x,y,z |
1_555 |
66 |
29 |
17769 |
401.5 |
-2.4 |
0.603 |
21 |
0 |
0 |
0.193 |
| Average: |
405.2 |
-2.5 |
0.591 |
22 |
0 |
0 |
0.193 |
| 12 |
14 |
|
[GDP]D:602 |
28 |
1 |
562 |
f |
D |
x,y,z |
1_555 |
61 |
27 |
16811 |
398.5 |
-6.9 |
0.528 |
12 |
0 |
0 |
0.201 |
15 |
|
[GDP]B:501 |
27 |
1 |
561 |
f |
B |
x,y,z |
1_555 |
65 |
28 |
16662 |
391.8 |
-6.2 |
0.579 |
12 |
0 |
0 |
0.201 |
| Average: |
395.2 |
-6.5 |
0.554 |
12 |
0 |
0 |
0.201 |
| 13 |
16 |
|
C |
55 |
11 |
17769 |
◊ |
A |
-x,y-1/2,-z+1/2 |
4_545 |
43 |
12 |
17896 |
384.6 |
-0.0 |
0.703 |
6 |
5 |
0 |
0.000 |
| 14 |
17 |
|
[2RR]B:504 |
29 |
1 |
615 |
◊ |
B |
x,y,z |
1_555 |
50 |
21 |
16662 |
380.8 |
2.2 |
0.324 |
2 |
0 |
0 |
0.000 |
18 |
|
[2RR]D:604 |
29 |
1 |
609 |
◊ |
D |
x,y,z |
1_555 |
48 |
19 |
16811 |
351.0 |
2.3 |
0.301 |
1 |
0 |
0 |
0.000 |
| Average: |
365.9 |
2.3 |
0.313 |
2 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[ADP]F:401 |
27 |
1 |
547 |
f |
F |
x,y,z |
1_555 |
46 |
20 |
16748 |
376.3 |
-4.1 |
0.475 |
5 |
0 |
0 |
0.100 |
| 16 |
20 |
|
C |
38 |
12 |
17769 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
33 |
13 |
17896 |
311.6 |
-1.1 |
0.522 |
2 |
0 |
0 |
0.000 |
| 17 |
21 |
|
C |
32 |
11 |
17769 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
26 |
5 |
12564 |
231.6 |
-1.1 |
0.566 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[MES]B:505 |
12 |
1 |
334 |
f |
B |
x,y,z |
1_555 |
31 |
12 |
16662 |
191.8 |
7.3 |
0.395 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
C |
23 |
5 |
17769 |
◊ |
B |
x-1/2,-y+1/2,-z |
3_455 |
26 |
8 |
16662 |
184.8 |
-0.6 |
0.548 |
2 |
1 |
0 |
0.000 |
| 20 |
24 |
|
D |
16 |
6 |
16811 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
17 |
8 |
12564 |
149.4 |
3.1 |
0.873 |
1 |
3 |
0 |
0.000 |
| 21 |
25 |
|
[2RR]D:604 |
13 |
1 |
609 |
f |
C |
x,y,z |
1_555 |
19 |
7 |
17769 |
128.1 |
0.5 |
0.350 |
1 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[2RR]B:504 |
13 |
1 |
615 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
17896 |
119.2 |
0.4 |
0.376 |
1 |
0 |
0 |
0.000 |
| 23 |
27 |
|
A |
6 |
3 |
17896 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
2 |
16748 |
87.9 |
0.2 |
0.411 |
1 |
1 |
0 |
0.000 |
| 24 |
28 |
|
[IMD]A:506 |
5 |
1 |
197 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
17896 |
86.6 |
1.8 |
0.156 |
1 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[GOL]A:505 |
5 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
17896 |
77.9 |
1.2 |
0.801 |
4 |
0 |
0 |
0.008 |
| 26 |
30 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
17896 |
63.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.143 |
| 27 |
31 |
|
B |
8 |
3 |
16662 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
9 |
3 |
12564 |
57.8 |
1.2 |
0.805 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
[GOL]A:505 |
4 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
16662 |
49.1 |
-0.8 |
0.423 |
0 |
0 |
0 |
0.012 |
| 29 |
33 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
16662 |
45.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.119 |
34 |
|
[MG]D:603 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
2 |
16811 |
42.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.119 |
35 |
|
[MG]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
16662 |
42.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.119 |
| Average: |
43.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.119 |
| 30 |
36 |
|
B |
5 |
4 |
16662 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
7 |
5 |
16811 |
44.2 |
0.4 |
0.714 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
17769 |
43.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.078 |
38 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
17896 |
42.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.078 |
| Average: |
43.0 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.078 |
| 32 |
39 |
|
[MES]B:505 |
4 |
1 |
334 |
◊ |
[IMD]A:506 |
x,y,z |
1_555 |
4 |
1 |
197 |
42.0 |
2.1 |
0.030 |
0 |
0 |
0 |
0.000 |
| 33 |
40 |
|
C |
7 |
4 |
17769 |
x |
C |
x-1/2,-y+1/2,-z |
3_455 |
10 |
5 |
17769 |
41.2 |
-0.7 |
0.440 |
0 |
0 |
0 |
0.000 |
| 34 |
41 |
|
[CA]E:700 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
17896 |
39.5 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.092 |
| 35 |
42 |
|
B |
5 |
3 |
16662 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
2 |
12564 |
38.0 |
-0.5 |
0.427 |
0 |
0 |
0 |
0.000 |
| 36 |
43 |
|
[GOL]A:505 |
4 |
1 |
217 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
12564 |
35.2 |
-0.4 |
0.530 |
0 |
0 |
0 |
0.005 |
| 37 |
44 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
5 |
1 |
625 |
33.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.066 |
45 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
5 |
1 |
627 |
30.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.066 |
| Average: |
32.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.066 |
| 38 |
46 |
|
[GDP]D:602 |
6 |
1 |
562 |
f |
[MG]D:603 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.074 |
| 39 |
47 |
|
[MES]B:505 |
5 |
1 |
334 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
17896 |
31.6 |
0.4 |
0.048 |
0 |
0 |
0 |
0.000 |
| 40 |
48 |
|
[GTP]C:501 |
3 |
1 |
627 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
16811 |
31.6 |
0.7 |
0.751 |
1 |
0 |
0 |
0.000 |
49 |
|
[GTP]A:501 |
4 |
1 |
625 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
16662 |
30.8 |
0.6 |
0.729 |
1 |
0 |
0 |
0.000 |
| Average: |
31.2 |
0.6 |
0.740 |
1 |
0 |
0 |
0.000 |
| 41 |
50 |
|
C |
7 |
5 |
17769 |
f |
[CA]B:503 |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
85 |
29.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.077 |
| 42 |
51 |
|
[CA]B:503 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
16662 |
28.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 43 |
52 |
|
D |
5 |
2 |
16811 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
4 |
2 |
17896 |
27.6 |
0.1 |
0.558 |
0 |
0 |
0 |
0.000 |
| 44 |
53 |
|
[MES]B:505 |
3 |
1 |
334 |
f |
[GOL]A:505 |
x,y,z |
1_555 |
3 |
1 |
217 |
27.5 |
0.1 |
0.104 |
0 |
0 |
0 |
0.000 |
| 45 |
54 |
|
[GDP]B:501 |
6 |
1 |
561 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.087 |
55 |
|
[GDP]B:501 |
2 |
1 |
561 |
f |
[MG]B:506 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.3 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.087 |
| Average: |
19.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.087 |
| 46 |
56 |
|
[IMD]A:506 |
3 |
1 |
197 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
16662 |
26.7 |
0.9 |
0.207 |
0 |
0 |
0 |
0.000 |
| 47 |
57 |
|
[MG]B:506 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
17769 |
23.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.037 |
58 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17769 |
3.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.037 |
| Average: |
13.8 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.037 |
| 48 |
59 |
|
[MG]B:506 |
1 |
1 |
98 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.062 |
| 49 |
60 |
|
[2RR]D:604 |
2 |
1 |
609 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
4 |
1 |
627 |
19.8 |
0.4 |
0.453 |
0 |
0 |
0 |
0.000 |
| 50 |
61 |
|
[CA]E:700 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12564 |
18.8 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.040 |
| 51 |
62 |
|
[MG]D:601 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
16811 |
16.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.015 |
63 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
16662 |
11.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.015 |
| Average: |
14.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.015 |
| 52 |
64 |
|
[IMD]A:506 |
2 |
1 |
197 |
◊ |
[GOL]A:505 |
x,y,z |
1_555 |
2 |
1 |
217 |
12.8 |
0.6 |
0.277 |
0 |
0 |
0 |
0.000 |
| 53 |
65 |
|
[MES]B:505 |
2 |
1 |
334 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12564 |
7.7 |
0.1 |
0.168 |
0 |
0 |
0 |
0.000 |
| 54 |
66 |
|
[IMD]A:506 |
2 |
1 |
197 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12564 |
2.8 |
0.1 |
0.176 |
0 |
0 |
0 |
0.000 |
|