| ## |
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 |
137 |
34 |
12423 |
◊ |
A |
x,y,z |
1_555 |
168 |
45 |
17568 |
1538.4 |
-18.5 |
0.157 |
19 |
3 |
0 |
0.351 |
| 2 |
2 |
|
B |
139 |
38 |
16940 |
◊ |
A |
x,y,z |
1_555 |
140 |
35 |
17568 |
1332.9 |
-13.1 |
0.109 |
13 |
7 |
0 |
0.280 |
3 |
|
D |
142 |
37 |
16819 |
◊ |
C |
x,y,z |
1_555 |
143 |
36 |
17820 |
1320.5 |
-14.5 |
0.087 |
14 |
5 |
0 |
0.280 |
| Average: |
1326.7 |
-13.8 |
0.098 |
14 |
6 |
0 |
0.280 |
| 3 |
4 |
|
D |
126 |
34 |
16819 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
124 |
28 |
17160 |
1163.8 |
1.1 |
0.598 |
13 |
0 |
0 |
0.000 |
| 4 |
5 |
|
B |
79 |
20 |
16940 |
◊ |
C |
x,y,z |
1_555 |
107 |
29 |
17820 |
815.5 |
-6.0 |
0.312 |
18 |
3 |
0 |
0.176 |
| 5 |
6 |
|
F |
76 |
21 |
17160 |
◊ |
A |
x,y,z |
1_555 |
83 |
22 |
17568 |
768.5 |
0.3 |
0.666 |
9 |
8 |
0 |
0.000 |
| 6 |
7 |
|
E |
75 |
16 |
12423 |
◊ |
C |
x,y,z |
1_555 |
84 |
24 |
17820 |
745.1 |
-9.9 |
0.149 |
6 |
4 |
0 |
0.135 |
| 7 |
8 |
|
E |
54 |
15 |
12423 |
◊ |
D |
x,y,z |
1_555 |
73 |
20 |
16819 |
636.9 |
-6.4 |
0.318 |
3 |
3 |
0 |
0.083 |
| 8 |
9 |
|
E |
62 |
15 |
12423 |
◊ |
B |
x,y,z |
1_555 |
81 |
22 |
16940 |
609.8 |
-2.9 |
0.604 |
3 |
4 |
0 |
0.039 |
| 9 |
10 |
|
C |
67 |
22 |
17820 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
47 |
12 |
12423 |
532.9 |
-3.2 |
0.528 |
4 |
2 |
0 |
0.000 |
| 10 |
11 |
|
C |
55 |
13 |
17820 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
49 |
13 |
17568 |
450.6 |
2.6 |
0.841 |
9 |
6 |
0 |
0.000 |
| 11 |
12 |
|
[GTP]D:602 |
31 |
1 |
633 |
f |
D |
x,y,z |
1_555 |
64 |
28 |
16819 |
444.9 |
-3.6 |
0.504 |
18 |
0 |
0 |
0.152 |
| 12 |
13 |
|
[GTP]C:501 |
31 |
1 |
629 |
f |
C |
x,y,z |
1_555 |
70 |
30 |
17820 |
415.4 |
-3.0 |
0.566 |
19 |
0 |
0 |
0.149 |
14 |
|
[GTP]A:501 |
31 |
1 |
634 |
f |
A |
x,y,z |
1_555 |
65 |
29 |
17568 |
414.0 |
-3.2 |
0.549 |
17 |
0 |
0 |
0.149 |
| Average: |
414.7 |
-3.1 |
0.558 |
18 |
0 |
0 |
0.149 |
| 13 |
15 |
|
[GDP]B:501 |
27 |
1 |
562 |
f |
B |
x,y,z |
1_555 |
63 |
30 |
16940 |
390.5 |
-6.6 |
0.571 |
16 |
0 |
0 |
0.166 |
| 14 |
16 |
|
F |
42 |
12 |
17160 |
◊ |
B |
x,y,z |
1_555 |
38 |
11 |
16940 |
388.2 |
-0.6 |
0.571 |
4 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[GDF]B:507 |
34 |
1 |
931 |
◊ |
C |
x,y,z |
1_555 |
43 |
13 |
17820 |
349.9 |
-3.0 |
0.744 |
2 |
0 |
0 |
0.048 |
| 16 |
18 |
|
[GDF]B:507 |
25 |
1 |
931 |
f |
B |
x,y,z |
1_555 |
46 |
13 |
16940 |
329.8 |
-6.1 |
0.396 |
0 |
0 |
0 |
0.074 |
| 17 |
19 |
|
C |
38 |
12 |
17820 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
37 |
14 |
17568 |
304.5 |
-1.1 |
0.521 |
3 |
0 |
0 |
0.000 |
| 18 |
20 |
|
C |
34 |
13 |
17820 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
27 |
6 |
12423 |
266.1 |
-1.7 |
0.522 |
2 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[MES]B:505 |
12 |
1 |
340 |
f |
B |
x,y,z |
1_555 |
33 |
11 |
16940 |
222.0 |
6.8 |
0.447 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
C |
25 |
6 |
17820 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
31 |
10 |
16940 |
198.4 |
-1.8 |
0.332 |
2 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[MES]B:504 |
12 |
1 |
340 |
◊ |
B |
x,y,z |
1_555 |
26 |
12 |
16940 |
197.1 |
7.8 |
0.409 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
B |
18 |
2 |
16940 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
20 |
5 |
16819 |
136.5 |
-2.7 |
0.185 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
B |
14 |
5 |
16940 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
12 |
5 |
12423 |
115.2 |
-1.5 |
0.377 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
D |
14 |
5 |
16819 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
13 |
6 |
12423 |
113.2 |
1.2 |
0.798 |
1 |
3 |
0 |
0.000 |
| 25 |
27 |
|
C |
8 |
4 |
17820 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
2 |
17160 |
101.7 |
-1.4 |
0.245 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
C |
8 |
4 |
17820 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
19 |
8 |
17820 |
67.3 |
0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
| 27 |
29 |
|
[CL]A:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
17568 |
63.3 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.114 |
| 28 |
30 |
|
D |
5 |
2 |
16819 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
5 |
2 |
17568 |
46.2 |
0.8 |
0.719 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
16819 |
46.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.073 |
32 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
16940 |
44.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
45.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.073 |
| 30 |
33 |
|
[GTP]C:501 |
6 |
1 |
629 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
16819 |
44.6 |
1.0 |
0.792 |
1 |
0 |
0 |
0.000 |
34 |
|
[GTP]A:501 |
6 |
1 |
634 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
16940 |
42.6 |
0.8 |
0.773 |
1 |
0 |
0 |
0.000 |
| Average: |
43.6 |
0.9 |
0.782 |
1 |
0 |
0 |
0.000 |
| 31 |
35 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
17568 |
43.6 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.071 |
36 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
17820 |
42.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.071 |
| Average: |
43.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.071 |
| 32 |
37 |
|
[CA]C:503 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
4 |
17820 |
42.9 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.166 |
38 |
|
[CA]A:503 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
17568 |
42.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.166 |
| Average: |
42.8 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.166 |
| 33 |
39 |
|
[CA]E:201 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
17568 |
36.6 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.072 |
| 34 |
40 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
[GTP]D:602 |
x,y,z |
1_555 |
6 |
1 |
633 |
36.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.114 |
41 |
|
[MG]C:502 |
1 |
1 |
98 |
f |
[GTP]C:501 |
x,y,z |
1_555 |
5 |
1 |
629 |
31.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.114 |
42 |
|
[MG]A:502 |
1 |
1 |
98 |
f |
[GTP]A:501 |
x,y,z |
1_555 |
5 |
1 |
634 |
30.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.114 |
| Average: |
32.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.114 |
| 35 |
43 |
|
B |
7 |
3 |
16940 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
2 |
12423 |
34.0 |
-0.2 |
0.511 |
0 |
0 |
0 |
0.000 |
| 36 |
44 |
|
[GDP]B:501 |
7 |
1 |
562 |
f |
[MG]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.056 |
| 37 |
45 |
|
[CA]B:503 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
16940 |
30.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.063 |
| 38 |
46 |
|
C |
5 |
2 |
17820 |
◊ |
[MG]B:506 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
98 |
29.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 39 |
47 |
|
[MG]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
16940 |
29.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.038 |
| 40 |
48 |
|
[MES]B:504 |
4 |
1 |
340 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
17568 |
26.1 |
0.0 |
0.044 |
0 |
0 |
0 |
0.000 |
| 41 |
49 |
|
C |
8 |
5 |
17820 |
◊ |
[CA]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
24.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 42 |
50 |
|
[CA]E:201 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
12423 |
20.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.038 |
| 43 |
51 |
|
B |
4 |
2 |
16940 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
17160 |
17.2 |
0.1 |
0.664 |
0 |
0 |
0 |
0.000 |
| 44 |
52 |
|
A |
2 |
1 |
17568 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
17160 |
16.9 |
0.4 |
0.460 |
0 |
0 |
0 |
0.000 |
| 45 |
53 |
|
D |
3 |
2 |
16819 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
4 |
3 |
16940 |
15.1 |
0.5 |
0.763 |
0 |
0 |
0 |
0.000 |
| 46 |
54 |
|
[MG]C:502 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
16819 |
12.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.007 |
55 |
|
[MG]A:502 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
16940 |
9.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
| Average: |
11.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.007 |
| 47 |
56 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17820 |
2.4 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
| 48 |
57 |
|
[MES]B:504 |
1 |
1 |
340 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
12423 |
0.7 |
0.0 |
0.317 |
0 |
0 |
0 |
0.000 |
|