## |
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 |
99 |
26 |
12032 |
◊ |
A |
x,y,z |
1_555 |
87 |
20 |
12517 |
799.7 |
-5.1 |
0.363 |
11 |
8 |
0 |
0.049 |
2 |
2 |
|
A |
53 |
12 |
12517 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
52 |
18 |
12032 |
413.7 |
-3.9 |
0.324 |
4 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
32 |
9 |
12032 |
◊ |
A |
-y,x-y,z |
2_555 |
48 |
15 |
12517 |
370.0 |
1.7 |
0.657 |
7 |
8 |
0 |
0.000 |
4 |
4 |
|
B |
35 |
12 |
12032 |
x |
B |
-y,x-y+1,z |
2_565 |
30 |
11 |
12032 |
252.5 |
-1.5 |
0.492 |
2 |
1 |
0 |
0.000 |
5 |
5 |
|
A |
22 |
6 |
12517 |
◊ |
B |
x+2/3,y+1/3,z+1/3 |
4_555 |
25 |
8 |
12032 |
211.1 |
2.0 |
0.755 |
4 |
11 |
0 |
0.000 |
6 |
6 |
|
[NAG]A:501 |
13 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
32 |
13 |
12517 |
206.8 |
4.2 |
0.384 |
3 |
0 |
0 |
0.000 |
7 |
|
[NAG]B:501 |
13 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
28 |
11 |
12032 |
201.7 |
3.9 |
0.364 |
2 |
0 |
0 |
0.000 |
Average: |
204.3 |
4.1 |
0.374 |
3 |
0 |
0 |
0.000 |
7 |
8 |
|
A |
13 |
5 |
12517 |
x |
A |
-y,x-y,z |
2_555 |
19 |
6 |
12517 |
154.3 |
0.2 |
0.633 |
2 |
1 |
0 |
0.000 |
8 |
9 |
|
[NAG]A:502 |
11 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
21 |
5 |
12517 |
128.3 |
1.7 |
0.244 |
0 |
0 |
0 |
0.000 |
10 |
|
[NAG]B:502 |
11 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
18 |
4 |
12032 |
105.0 |
0.9 |
0.194 |
0 |
0 |
0 |
0.000 |
Average: |
116.7 |
1.3 |
0.219 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
[NAG]B:511 |
11 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
14 |
6 |
12032 |
106.7 |
2.9 |
0.313 |
2 |
0 |
0 |
0.000 |
12 |
|
[NAG]A:511 |
11 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
14 |
6 |
12517 |
106.2 |
2.8 |
0.307 |
2 |
0 |
0 |
0.000 |
Average: |
106.5 |
2.8 |
0.310 |
2 |
0 |
0 |
0.000 |
10 |
13 |
|
[NAG]A:512 |
7 |
1 |
365 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12517 |
105.8 |
2.7 |
0.487 |
1 |
0 |
0 |
0.000 |
14 |
|
[NAG]B:512 |
6 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
12032 |
104.2 |
2.8 |
0.542 |
1 |
0 |
0 |
0.000 |
Average: |
105.0 |
2.8 |
0.515 |
1 |
0 |
0 |
0.000 |
11 |
15 |
|
[NAG]A:511 |
7 |
1 |
359 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
12032 |
90.3 |
2.6 |
0.439 |
2 |
0 |
0 |
0.000 |
12 |
16 |
|
A |
11 |
5 |
12517 |
◊ |
[NAG]B:511 |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
7 |
1 |
362 |
85.5 |
2.6 |
0.474 |
2 |
0 |
0 |
0.000 |
13 |
17 |
|
[NAG]A:502 |
9 |
1 |
363 |
cf |
[NAG]A:501 |
x,y,z |
1_555 |
7 |
1 |
365 |
76.4 |
1.7 |
0.092 |
0 |
0 |
0 |
0.000 |
18 |
|
[NAG]B:502 |
9 |
1 |
363 |
cf |
[NAG]B:501 |
x,y,z |
1_555 |
7 |
1 |
365 |
76.2 |
1.8 |
0.108 |
0 |
0 |
0 |
0.000 |
Average: |
76.3 |
1.8 |
0.100 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[NAG]B:512 |
9 |
1 |
364 |
cf |
[NAG]B:511 |
x,y,z |
1_555 |
6 |
1 |
362 |
72.5 |
1.8 |
0.091 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]A:512 |
9 |
1 |
365 |
cf |
[NAG]A:511 |
x,y,z |
1_555 |
6 |
1 |
359 |
69.6 |
1.6 |
0.086 |
0 |
0 |
0 |
0.000 |
Average: |
71.1 |
1.7 |
0.089 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[MAN]B:514 |
6 |
1 |
291 |
◊ |
A |
x,y,z |
1_555 |
11 |
2 |
12517 |
71.4 |
-0.6 |
0.124 |
0 |
0 |
0 |
0.003 |
16 |
22 |
|
[MAN]A:514 |
6 |
1 |
292 |
cf |
[BMA]A:513 |
x,y,z |
1_555 |
6 |
1 |
291 |
60.0 |
2.7 |
0.266 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[MAN]B:504 |
6 |
1 |
290 |
cf |
[BMA]B:503 |
x,y,z |
1_555 |
5 |
1 |
293 |
59.1 |
2.5 |
0.292 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[MAN]B:515 |
5 |
1 |
294 |
cf |
[BMA]B:513 |
x,y,z |
1_555 |
6 |
1 |
289 |
59.1 |
2.8 |
0.244 |
0 |
0 |
0 |
0.000 |
19 |
25 |
|
[BMA]B:513 |
6 |
1 |
289 |
cf |
[NAG]B:512 |
x,y,z |
1_555 |
4 |
1 |
364 |
58.4 |
1.0 |
0.127 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
[BMA]A:513 |
7 |
1 |
291 |
cf |
[NAG]A:512 |
x,y,z |
1_555 |
6 |
1 |
365 |
58.3 |
1.0 |
0.105 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
[MAN]B:514 |
6 |
1 |
291 |
cf |
[BMA]B:513 |
x,y,z |
1_555 |
5 |
1 |
289 |
58.3 |
2.6 |
0.266 |
0 |
0 |
0 |
0.000 |
22 |
28 |
|
[BMA]B:503 |
7 |
1 |
293 |
cf |
[NAG]B:502 |
x,y,z |
1_555 |
5 |
1 |
363 |
57.0 |
1.4 |
0.131 |
0 |
0 |
0 |
0.000 |
23 |
29 |
|
[MAN]A:515 |
7 |
1 |
292 |
cf |
[BMA]A:513 |
x,y,z |
1_555 |
5 |
1 |
291 |
56.7 |
2.6 |
0.232 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[NA]B:602 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
12032 |
50.5 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.030 |
25 |
31 |
|
[CL]A:601 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12517 |
49.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.052 |
32 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
12032 |
46.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.052 |
Average: |
48.3 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.052 |
26 |
33 |
|
[MAN]B:515 |
6 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
7 |
1 |
12032 |
49.5 |
-0.0 |
0.177 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[MAN]A:515 |
4 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
8 |
1 |
12517 |
49.5 |
0.7 |
0.315 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
12517 |
48.9 |
-33.6 |
0.000 |
0 |
0 |
0 |
0.262 |
36 |
|
[ZN]B:403 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
12032 |
37.9 |
-26.1 |
0.000 |
0 |
0 |
0 |
0.262 |
Average: |
43.4 |
-29.8 |
0.000 |
0 |
0 |
0 |
0.262 |
29 |
37 |
|
A |
6 |
3 |
12517 |
◊ |
[NAG]B:512 |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
7 |
1 |
364 |
46.8 |
1.7 |
0.277 |
1 |
0 |
0 |
0.000 |
30 |
38 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
12517 |
44.5 |
-33.2 |
0.000 |
0 |
0 |
0 |
0.289 |
39 |
|
[ZN]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
12032 |
42.8 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.289 |
Average: |
43.6 |
-32.9 |
0.000 |
0 |
0 |
0 |
0.289 |
31 |
40 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12517 |
40.8 |
-31.4 |
0.000 |
0 |
0 |
0 |
0.275 |
41 |
|
[ZN]B:401 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
5 |
4 |
12032 |
40.2 |
-31.1 |
0.000 |
0 |
0 |
0 |
0.275 |
Average: |
40.5 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.275 |
32 |
42 |
|
[NAG]A:512 |
6 |
1 |
365 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
12032 |
40.8 |
1.6 |
0.273 |
1 |
0 |
0 |
0.000 |
33 |
43 |
|
[MAN]B:504 |
3 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
12032 |
40.5 |
0.5 |
0.393 |
0 |
0 |
0 |
0.000 |
34 |
44 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
[NAG]B:512 |
x,y,z |
1_555 |
6 |
1 |
364 |
38.7 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.031 |
45 |
|
[CL]A:601 |
1 |
1 |
125 |
f |
[NAG]A:512 |
x,y,z |
1_555 |
6 |
1 |
365 |
35.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
37.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.031 |
35 |
46 |
|
[BMA]A:513 |
4 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
8 |
1 |
12517 |
38.0 |
0.0 |
0.274 |
0 |
0 |
0 |
0.000 |
36 |
47 |
|
[BMA]B:513 |
3 |
1 |
289 |
f |
B |
x,y,z |
1_555 |
7 |
1 |
12032 |
35.1 |
0.2 |
0.325 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
[MAN]A:514 |
3 |
1 |
292 |
◊ |
B |
-x+y-1/3,-x+1/3,z+1/3 |
6_455 |
7 |
2 |
12032 |
33.7 |
-0.9 |
0.134 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[ZN]B:403 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12517 |
27.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.052 |
39 |
50 |
|
[MAN]B:504 |
4 |
1 |
290 |
◊ |
[NAG]A:512 |
x,y,z |
1_555 |
2 |
1 |
365 |
26.2 |
0.9 |
0.257 |
0 |
0 |
0 |
0.000 |
40 |
51 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
[NAG]B:511 |
x,y,z |
1_555 |
4 |
1 |
362 |
22.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.016 |
52 |
|
[CL]A:601 |
1 |
1 |
125 |
f |
[NAG]A:511 |
x,y,z |
1_555 |
4 |
1 |
359 |
21.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.016 |
Average: |
22.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.016 |
41 |
53 |
|
[MAN]B:504 |
3 |
1 |
290 |
◊ |
[MAN]A:514 |
x,y,z |
1_555 |
2 |
1 |
292 |
19.2 |
0.2 |
0.221 |
0 |
0 |
0 |
0.000 |
42 |
54 |
|
[ZN]B:402 |
1 |
1 |
98 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.1 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.057 |
43 |
55 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.0 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.056 |
44 |
56 |
|
[MAN]A:514 |
3 |
1 |
292 |
f |
[NAG]A:512 |
x,y,z |
1_555 |
3 |
1 |
365 |
13.3 |
0.3 |
0.213 |
0 |
0 |
0 |
0.000 |
45 |
57 |
|
[MAN]A:515 |
2 |
1 |
292 |
f |
[NAG]A:512 |
x,y,z |
1_555 |
1 |
1 |
365 |
12.0 |
0.5 |
0.307 |
0 |
0 |
0 |
0.000 |
46 |
58 |
|
[MAN]B:504 |
2 |
1 |
290 |
f |
[NAG]B:502 |
x,y,z |
1_555 |
2 |
1 |
363 |
12.0 |
0.4 |
0.232 |
0 |
0 |
0 |
0.000 |
47 |
59 |
|
[BMA]B:503 |
2 |
1 |
293 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
12032 |
11.8 |
0.2 |
0.331 |
0 |
0 |
0 |
0.000 |
48 |
60 |
|
[MAN]B:504 |
1 |
1 |
290 |
◊ |
[BMA]A:513 |
x,y,z |
1_555 |
3 |
1 |
291 |
9.4 |
0.1 |
0.218 |
0 |
0 |
0 |
0.000 |
49 |
61 |
|
[BMA]B:513 |
1 |
1 |
289 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
12517 |
9.3 |
-0.6 |
0.146 |
0 |
0 |
0 |
0.003 |
50 |
62 |
|
[MAN]B:515 |
2 |
1 |
294 |
f |
[NAG]B:512 |
x,y,z |
1_555 |
1 |
1 |
364 |
8.7 |
0.4 |
0.275 |
0 |
0 |
0 |
0.000 |
51 |
63 |
|
[MAN]B:514 |
4 |
1 |
291 |
f |
[NAG]B:512 |
x,y,z |
1_555 |
1 |
1 |
364 |
7.9 |
-0.0 |
0.116 |
0 |
0 |
0 |
0.000 |
52 |
64 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.020 |
53 |
65 |
|
[ZN]B:403 |
1 |
1 |
98 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.016 |
54 |
66 |
|
[CL]B:601 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12517 |
2.1 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.001 |
55 |
67 |
|
[MAN]B:504 |
1 |
1 |
290 |
◊ |
[NAG]A:511 |
x,y,z |
1_555 |
1 |
1 |
359 |
1.6 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
56 |
68 |
|
[NA]B:602 |
1 |
1 |
125 |
◊ |
B |
-y,x-y+1,z |
2_565 |
1 |
1 |
12032 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
69 |
|
[ZN]B:402 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12517 |
0.2 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|