## |
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 |
299 |
80 |
18410 |
◊ |
A |
x,y,z |
1_555 |
299 |
82 |
19425 |
2906.5 |
-28.4 |
0.114 |
42 |
3 |
0 |
0.594 |
2 |
2 |
|
B |
85 |
30 |
18410 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
3_546 |
101 |
28 |
19425 |
861.4 |
-6.0 |
0.416 |
4 |
0 |
0 |
0.245 |
3 |
3 |
|
B |
75 |
21 |
18410 |
◊ |
B |
-x,-y,z |
2_555 |
75 |
21 |
18410 |
745.0 |
-0.5 |
0.725 |
11 |
0 |
0 |
0.082 |
4 |
4 |
|
A |
67 |
23 |
19425 |
x |
A |
-x+1/2,y-1/2,-z+1 |
3_546 |
76 |
26 |
19425 |
609.2 |
0.7 |
0.753 |
10 |
4 |
0 |
0.000 |
5 |
5 |
|
B |
43 |
13 |
18410 |
◊ |
A |
x,y,z-1 |
1_554 |
41 |
14 |
19425 |
372.0 |
-3.8 |
0.357 |
5 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
21 |
7 |
19425 |
x |
A |
x,y,z-1 |
1_554 |
21 |
6 |
19425 |
196.3 |
0.9 |
0.728 |
1 |
1 |
0 |
0.000 |
7 |
7 |
|
[PG4]A:609 |
13 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
23 |
9 |
19425 |
189.9 |
4.2 |
0.308 |
3 |
0 |
0 |
0.000 |
8 |
8 |
|
A |
23 |
9 |
19425 |
◊ |
[PG4]A:610 |
-x+1/2,y-1/2,-z+1 |
3_546 |
12 |
1 |
402 |
176.0 |
5.1 |
0.370 |
1 |
0 |
0 |
0.000 |
9 |
9 |
|
[NAG]B:601 |
13 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
22 |
8 |
18410 |
151.7 |
3.5 |
0.311 |
2 |
0 |
0 |
0.000 |
10 |
10 |
|
[NAG]A:601 |
13 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
18 |
6 |
19425 |
144.6 |
3.2 |
0.256 |
1 |
0 |
0 |
0.000 |
11 |
11 |
|
[NAG]A:602 |
12 |
1 |
358 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
19425 |
138.1 |
2.4 |
0.270 |
2 |
0 |
0 |
0.000 |
12 |
12 |
|
[NAG]B:602 |
11 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
18410 |
127.4 |
2.0 |
0.282 |
0 |
0 |
0 |
0.000 |
13 |
13 |
|
[SO4]B:609 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
18410 |
115.4 |
-17.7 |
0.668 |
2 |
0 |
0 |
0.588 |
14 |
14 |
|
[PG4]A:610 |
8 |
1 |
402 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
19425 |
106.1 |
1.3 |
0.261 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[SO4]A:607 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
19425 |
91.5 |
-12.9 |
0.776 |
0 |
0 |
0 |
0.409 |
16 |
16 |
|
[GOL]B:608 |
5 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
18410 |
86.6 |
-1.0 |
0.449 |
1 |
0 |
0 |
0.045 |
17 |
17 |
|
[SO4]A:608 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
19425 |
83.6 |
-11.1 |
0.815 |
5 |
0 |
0 |
0.423 |
18 |
18 |
|
[BMA]A:603 |
8 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
19425 |
81.9 |
1.0 |
0.261 |
0 |
0 |
0 |
0.000 |
19 |
19 |
|
[BMA]B:603 |
8 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
18410 |
81.8 |
0.8 |
0.234 |
0 |
0 |
0 |
0.000 |
20 |
20 |
|
A |
10 |
2 |
19425 |
x |
A |
-x+1/2,y-1/2,-z |
3_545 |
11 |
3 |
19425 |
75.3 |
0.4 |
0.649 |
1 |
0 |
0 |
0.000 |
21 |
21 |
|
[SO4]A:608 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
18410 |
75.2 |
-9.9 |
0.774 |
3 |
0 |
0 |
0.140 |
22 |
22 |
|
[NAG]B:602 |
9 |
1 |
364 |
cf |
[NAG]B:601 |
x,y,z |
1_555 |
7 |
1 |
363 |
75.1 |
2.1 |
0.098 |
1 |
0 |
0 |
0.000 |
23 |
|
[NAG]A:602 |
9 |
1 |
358 |
cf |
[NAG]A:601 |
x,y,z |
1_555 |
7 |
1 |
362 |
72.5 |
1.5 |
0.064 |
1 |
0 |
0 |
0.000 |
Average: |
73.8 |
1.8 |
0.081 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
[MAN]B:606 |
7 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
18410 |
69.1 |
0.2 |
0.216 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[MAN]A:605 |
7 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
19425 |
65.1 |
0.4 |
0.181 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[MAN]B:606 |
6 |
1 |
290 |
cf |
[MAN]B:604 |
x,y,z |
1_555 |
5 |
1 |
292 |
63.8 |
2.0 |
0.167 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
[MAN]B:605 |
6 |
1 |
295 |
cf |
[BMA]B:603 |
x,y,z |
1_555 |
5 |
1 |
291 |
59.5 |
2.5 |
0.280 |
1 |
0 |
0 |
0.000 |
27 |
28 |
|
[SO4]A:606 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
19425 |
58.4 |
-7.3 |
0.804 |
2 |
0 |
0 |
0.261 |
28 |
29 |
|
B |
7 |
3 |
18410 |
◊ |
[SO4]A:606 |
-x+1/2,y-1/2,-z+1 |
3_546 |
5 |
1 |
185 |
58.3 |
-8.1 |
0.470 |
0 |
0 |
0 |
0.256 |
29 |
30 |
|
[BMA]A:603 |
7 |
1 |
292 |
cf |
[NAG]A:602 |
x,y,z |
1_555 |
5 |
1 |
358 |
58.1 |
1.1 |
0.107 |
0 |
0 |
0 |
0.000 |
31 |
|
[BMA]B:603 |
7 |
1 |
291 |
cf |
[NAG]B:602 |
x,y,z |
1_555 |
5 |
1 |
364 |
56.7 |
0.8 |
0.098 |
0 |
0 |
0 |
0.000 |
Average: |
57.4 |
1.0 |
0.103 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
B |
6 |
3 |
18410 |
f |
[PG4]A:609 |
x,y,z-1 |
1_554 |
6 |
1 |
407 |
57.3 |
2.0 |
0.400 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[MAN]B:607 |
6 |
1 |
289 |
cf |
[MAN]B:604 |
x,y,z |
1_555 |
6 |
1 |
292 |
55.2 |
1.8 |
0.160 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[MAN]A:605 |
5 |
1 |
290 |
cf |
[MAN]A:604 |
x,y,z |
1_555 |
6 |
1 |
293 |
54.9 |
2.2 |
0.209 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
[MAN]A:604 |
6 |
1 |
293 |
cf |
[BMA]A:603 |
x,y,z |
1_555 |
3 |
1 |
292 |
51.1 |
2.2 |
0.278 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[MAN]B:604 |
6 |
1 |
292 |
cf |
[BMA]B:603 |
x,y,z |
1_555 |
5 |
1 |
291 |
50.5 |
2.2 |
0.239 |
0 |
0 |
0 |
0.000 |
35 |
37 |
|
[MAN]A:604 |
4 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
19425 |
48.3 |
0.9 |
0.306 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[SO4]A:606 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
18410 |
47.5 |
-6.2 |
0.583 |
1 |
0 |
0 |
0.083 |
37 |
39 |
|
B |
7 |
2 |
18410 |
◊ |
A |
-x,-y,z |
2_555 |
8 |
3 |
19425 |
47.3 |
0.1 |
0.644 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
[MAN]B:604 |
4 |
1 |
292 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
18410 |
45.2 |
0.7 |
0.305 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
[MAN]A:605 |
6 |
1 |
290 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
18410 |
42.3 |
1.6 |
0.328 |
1 |
0 |
0 |
0.000 |
40 |
42 |
|
[MAN]B:607 |
3 |
1 |
289 |
f |
[MAN]B:606 |
x,y,z |
1_555 |
3 |
1 |
290 |
39.4 |
1.9 |
0.366 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
[MAN]B:607 |
4 |
1 |
289 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
18410 |
38.5 |
0.6 |
0.315 |
2 |
0 |
0 |
0.009 |
42 |
44 |
|
[MAN]B:607 |
4 |
1 |
289 |
f |
[BMA]B:603 |
x,y,z |
1_555 |
4 |
1 |
291 |
35.8 |
1.2 |
0.239 |
0 |
0 |
0 |
0.000 |
43 |
45 |
|
[SO4]B:609 |
4 |
1 |
186 |
◊ |
B |
-x,-y,z |
2_555 |
3 |
1 |
18410 |
30.5 |
-3.4 |
0.706 |
1 |
0 |
0 |
0.117 |
44 |
46 |
|
[MAN]B:605 |
4 |
1 |
295 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
18410 |
25.1 |
0.5 |
0.237 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[BMA]A:603 |
1 |
1 |
292 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
18410 |
19.0 |
-0.4 |
0.340 |
0 |
0 |
0 |
0.006 |
46 |
48 |
|
A |
2 |
1 |
19425 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
2 |
1 |
18410 |
16.2 |
-0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
[MAN]B:607 |
2 |
1 |
289 |
f |
[MAN]B:605 |
x,y,z |
1_555 |
6 |
1 |
295 |
14.9 |
0.7 |
0.167 |
0 |
0 |
0 |
0.000 |
48 |
50 |
|
B |
4 |
2 |
18410 |
◊ |
B |
-x,-y+1,z |
2_565 |
4 |
2 |
18410 |
14.2 |
-0.4 |
0.468 |
0 |
0 |
0 |
0.000 |
49 |
51 |
|
[MAN]B:604 |
2 |
1 |
292 |
f |
[NAG]B:602 |
x,y,z |
1_555 |
1 |
1 |
364 |
13.2 |
0.6 |
0.275 |
0 |
0 |
0 |
0.000 |
50 |
52 |
|
[MAN]A:604 |
2 |
1 |
293 |
f |
[NAG]A:602 |
x,y,z |
1_555 |
2 |
1 |
358 |
13.0 |
0.5 |
0.232 |
0 |
0 |
0 |
0.000 |
51 |
53 |
|
[MAN]B:607 |
2 |
1 |
289 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
19425 |
10.6 |
0.4 |
0.484 |
0 |
0 |
0 |
0.000 |
52 |
54 |
|
[MAN]A:605 |
1 |
1 |
290 |
f |
[BMA]A:603 |
x,y,z |
1_555 |
1 |
1 |
292 |
9.2 |
0.4 |
0.182 |
0 |
0 |
0 |
0.000 |
53 |
55 |
|
A |
2 |
1 |
19425 |
◊ |
[SO4]A:607 |
-x+1/2,y-1/2,-z+1 |
3_546 |
1 |
1 |
185 |
7.9 |
-0.8 |
0.771 |
0 |
0 |
0 |
0.000 |
54 |
56 |
|
A |
1 |
1 |
19425 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
3_546 |
2 |
1 |
18410 |
7.8 |
-0.1 |
0.383 |
0 |
0 |
0 |
0.000 |
55 |
57 |
|
[MAN]B:605 |
2 |
1 |
295 |
f |
[NAG]B:602 |
x,y,z |
1_555 |
1 |
1 |
364 |
6.0 |
0.0 |
0.194 |
0 |
0 |
0 |
0.000 |
56 |
58 |
|
[GOL]B:608 |
1 |
1 |
218 |
◊ |
B |
-x,-y,z |
2_555 |
1 |
1 |
18410 |
2.8 |
-0.1 |
0.456 |
0 |
0 |
0 |
0.003 |
57 |
59 |
|
B |
1 |
1 |
18410 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
19425 |
1.5 |
0.1 |
0.713 |
0 |
0 |
0 |
0.000 |
58 |
60 |
|
[MAN]A:604 |
1 |
1 |
293 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
18410 |
0.2 |
0.0 |
0.345 |
0 |
0 |
0 |
0.000 |
59 |
61 |
|
[MAN]B:606 |
1 |
1 |
290 |
f |
[BMA]B:603 |
x,y,z |
1_555 |
1 |
1 |
291 |
0.1 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
|