## |
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 |
|
A |
104 |
36 |
16662 |
◊ |
A |
y,x,-z |
4_555 |
102 |
35 |
16662 |
955.0 |
-9.0 |
0.350 |
8 |
4 |
0 |
0.000 |
2 |
|
B |
92 |
29 |
16686 |
◊ |
C |
y,x-1,-z |
4_545 |
99 |
31 |
16353 |
912.5 |
-11.1 |
0.173 |
6 |
0 |
0 |
0.000 |
Average: |
933.8 |
-10.1 |
0.262 |
7 |
2 |
0 |
0.000 |
2 |
3 |
|
A |
49 |
13 |
16662 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
49 |
13 |
16662 |
472.5 |
-6.2 |
0.235 |
2 |
0 |
0 |
0.000 |
4 |
|
C |
40 |
12 |
16353 |
◊ |
B |
x-y,-y,-z+1/3 |
5_555 |
39 |
12 |
16686 |
371.2 |
-5.5 |
0.191 |
2 |
0 |
0 |
0.000 |
Average: |
421.8 |
-5.8 |
0.213 |
2 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
45 |
16 |
16686 |
◊ |
A |
x,y,z |
1_555 |
55 |
15 |
16662 |
470.1 |
-3.1 |
0.503 |
3 |
1 |
0 |
0.000 |
6 |
|
C |
52 |
17 |
16353 |
◊ |
A |
x,y,z |
1_555 |
47 |
17 |
16662 |
455.9 |
-2.2 |
0.530 |
4 |
2 |
0 |
0.000 |
Average: |
463.0 |
-2.6 |
0.516 |
4 |
2 |
0 |
0.000 |
4 |
7 |
|
B |
38 |
13 |
16686 |
◊ |
C |
-x+1,-x+y,-z-1/3 |
6_654 |
37 |
13 |
16353 |
364.2 |
-8.0 |
0.049 |
0 |
0 |
0 |
0.000 |
8 |
|
A |
38 |
14 |
16662 |
◊ |
A |
-x,-x+y,-z-1/3 |
6_554 |
37 |
14 |
16662 |
354.2 |
-7.1 |
0.090 |
2 |
0 |
0 |
0.000 |
Average: |
359.2 |
-7.6 |
0.070 |
1 |
0 |
0 |
0.000 |
5 |
9 |
|
[C5P]C:607 |
20 |
1 |
475 |
f |
C |
x,y,z |
1_555 |
41 |
15 |
16353 |
281.5 |
-4.4 |
0.502 |
5 |
0 |
0 |
0.009 |
6 |
10 |
|
[C5P]A:607 |
18 |
1 |
450 |
f |
A |
x,y,z |
1_555 |
36 |
15 |
16662 |
248.0 |
-3.8 |
0.571 |
8 |
0 |
0 |
0.009 |
7 |
11 |
|
[RP5]B:611 |
13 |
1 |
348 |
f |
B |
x,y,z |
1_555 |
28 |
12 |
16686 |
172.3 |
2.9 |
0.619 |
6 |
0 |
0 |
0.000 |
8 |
12 |
|
A |
18 |
6 |
16662 |
x |
A |
-y,x-y,z-1/3 |
2_554 |
20 |
7 |
16662 |
169.9 |
-0.2 |
0.630 |
1 |
1 |
0 |
0.000 |
13 |
|
C |
17 |
6 |
16353 |
x |
C |
-y+1,x-y,z-1/3 |
2_654 |
11 |
4 |
16353 |
121.5 |
0.7 |
0.715 |
0 |
2 |
0 |
0.000 |
14 |
|
B |
13 |
6 |
16686 |
x |
B |
-y,x-y-1,z-1/3 |
2_544 |
11 |
6 |
16686 |
113.7 |
-0.5 |
0.564 |
1 |
1 |
0 |
0.000 |
Average: |
135.1 |
0.0 |
0.636 |
1 |
1 |
0 |
0.000 |
9 |
15 |
|
[NAG]C:604 |
11 |
1 |
351 |
cf |
C |
x,y,z |
1_555 |
19 |
11 |
16353 |
159.4 |
4.3 |
0.533 |
1 |
0 |
0 |
0.000 |
10 |
16 |
|
[NAG]A:602 |
12 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
24 |
7 |
16662 |
158.9 |
3.3 |
0.377 |
2 |
0 |
0 |
0.000 |
17 |
|
[NAG]C:602 |
11 |
1 |
367 |
cf |
C |
x,y,z |
1_555 |
23 |
7 |
16353 |
158.8 |
3.4 |
0.395 |
0 |
0 |
0 |
0.000 |
Average: |
158.8 |
3.3 |
0.386 |
1 |
0 |
0 |
0.000 |
11 |
18 |
|
[NAG]B:605 |
12 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
19 |
10 |
16686 |
158.5 |
4.4 |
0.498 |
0 |
0 |
0 |
0.000 |
12 |
19 |
|
[NAG]B:602 |
12 |
1 |
351 |
cf |
B |
x,y,z |
1_555 |
20 |
7 |
16686 |
153.7 |
3.4 |
0.378 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[NAG]A:604 |
9 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
18 |
8 |
16662 |
143.2 |
3.7 |
0.481 |
3 |
0 |
0 |
0.000 |
14 |
21 |
|
C |
18 |
8 |
16353 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
16686 |
128.2 |
-0.8 |
0.427 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[NAG]A:603 |
10 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
13 |
6 |
16662 |
122.0 |
3.0 |
0.405 |
0 |
0 |
0 |
0.000 |
23 |
|
[NAG]C:603 |
10 |
1 |
366 |
cf |
C |
x,y,z |
1_555 |
11 |
4 |
16353 |
103.2 |
2.5 |
0.349 |
0 |
0 |
0 |
0.000 |
Average: |
112.6 |
2.7 |
0.377 |
0 |
0 |
0 |
0.000 |
16 |
24 |
|
B |
13 |
6 |
16686 |
◊ |
[NAG]C:601 |
y,x-1,-z |
4_545 |
9 |
1 |
369 |
114.7 |
2.0 |
0.331 |
1 |
0 |
0 |
0.000 |
25 |
|
[NAG]A:601 |
9 |
1 |
364 |
◊ |
A |
y,x,-z |
4_555 |
14 |
6 |
16662 |
111.1 |
2.0 |
0.345 |
1 |
0 |
0 |
0.000 |
26 |
|
[NAG]B:601 |
8 |
1 |
362 |
◊ |
C |
y,x-1,-z |
4_545 |
14 |
6 |
16353 |
103.6 |
2.1 |
0.409 |
1 |
0 |
0 |
0.000 |
Average: |
109.8 |
2.0 |
0.362 |
1 |
0 |
0 |
0.000 |
17 |
27 |
|
[NAG]B:604 |
9 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
11 |
4 |
16686 |
95.3 |
2.9 |
0.408 |
0 |
0 |
0 |
0.000 |
18 |
28 |
|
[NAG]B:601 |
7 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
9 |
5 |
16686 |
87.0 |
2.6 |
0.531 |
1 |
0 |
0 |
0.000 |
29 |
|
[NAG]A:601 |
7 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
10 |
6 |
16662 |
86.9 |
2.5 |
0.517 |
0 |
0 |
0 |
0.000 |
30 |
|
[NAG]C:601 |
6 |
1 |
369 |
cf |
C |
x,y,z |
1_555 |
10 |
6 |
16353 |
84.8 |
2.4 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
86.2 |
2.5 |
0.534 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
[NAG]B:603 |
8 |
1 |
350 |
cf |
[NAG]B:602 |
x,y,z |
1_555 |
10 |
1 |
351 |
80.8 |
2.2 |
0.075 |
1 |
0 |
0 |
0.000 |
20 |
32 |
|
[MLI]B:610 |
6 |
1 |
228 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
16686 |
80.1 |
0.7 |
0.583 |
0 |
0 |
0 |
0.000 |
21 |
33 |
|
[MLI]B:610 |
7 |
1 |
228 |
◊ |
C |
-x+1,-x+y,-z-1/3 |
6_654 |
9 |
4 |
16353 |
72.7 |
2.1 |
0.886 |
0 |
0 |
0 |
0.000 |
22 |
34 |
|
[SCN]C:609 |
3 |
1 |
177 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
16353 |
63.8 |
-0.4 |
0.660 |
0 |
0 |
0 |
0.000 |
23 |
35 |
|
[SCN]C:608 |
3 |
1 |
178 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
16353 |
51.4 |
-0.6 |
0.586 |
0 |
0 |
0 |
0.000 |
24 |
36 |
|
[NAG]B:603 |
5 |
1 |
350 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
16686 |
49.8 |
0.2 |
0.229 |
0 |
0 |
0 |
0.000 |
25 |
37 |
|
[GOL]B:609 |
4 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
16686 |
46.6 |
0.8 |
0.744 |
1 |
0 |
0 |
0.000 |
26 |
38 |
|
[GOL]B:608 |
4 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
16686 |
44.7 |
-0.7 |
0.418 |
0 |
0 |
0 |
0.001 |
27 |
39 |
|
[NAG]A:604 |
7 |
1 |
355 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
16353 |
38.6 |
1.9 |
0.272 |
1 |
0 |
0 |
0.000 |
28 |
40 |
|
[NAG]B:605 |
6 |
1 |
363 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
16662 |
37.8 |
1.4 |
0.318 |
1 |
0 |
0 |
0.000 |
29 |
41 |
|
[ZN]B:606 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
16686 |
33.9 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.080 |
42 |
|
[ZN]B:607 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
16686 |
33.6 |
-24.3 |
0.000 |
0 |
0 |
0 |
0.080 |
43 |
|
[ZN]C:605 |
1 |
1 |
98 |
cf |
C |
x,y,z |
1_555 |
5 |
4 |
16353 |
33.5 |
-24.7 |
0.000 |
0 |
0 |
0 |
0.080 |
44 |
|
[ZN]A:606 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
16662 |
33.4 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.080 |
45 |
|
[ZN]C:606 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
5 |
16353 |
32.6 |
-24.2 |
0.000 |
0 |
0 |
0 |
0.080 |
46 |
|
[ZN]A:605 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
16662 |
31.2 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
33.0 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.080 |
30 |
47 |
|
[C5P]C:607 |
4 |
1 |
475 |
cf |
[ZN]C:606 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.3 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.017 |
48 |
|
[C5P]A:607 |
5 |
1 |
450 |
f |
[ZN]A:605 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.1 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.017 |
Average: |
28.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.017 |
31 |
49 |
|
[RP5]B:611 |
4 |
1 |
348 |
cf |
[ZN]B:607 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.2 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.015 |
32 |
50 |
|
[C5P]A:607 |
4 |
1 |
450 |
cf |
[ZN]A:606 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.4 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.014 |
33 |
51 |
|
[C5P]C:607 |
3 |
1 |
475 |
f |
[ZN]C:605 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.1 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.015 |
34 |
52 |
|
[RP5]B:611 |
4 |
1 |
348 |
f |
[ZN]B:606 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.5 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.014 |
35 |
53 |
|
[ZN]B:607 |
1 |
1 |
98 |
f |
[ZN]B:606 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.015 |
36 |
54 |
|
[ZN]A:606 |
1 |
1 |
98 |
f |
[ZN]A:605 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.012 |
37 |
55 |
|
B |
1 |
1 |
16686 |
◊ |
[GOL]B:608 |
-y,x-y-1,z-1/3 |
2_544 |
1 |
1 |
222 |
10.8 |
0.2 |
0.654 |
0 |
0 |
0 |
0.000 |
38 |
56 |
|
[ZN]C:606 |
1 |
1 |
98 |
f |
[ZN]C:605 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.010 |
39 |
57 |
|
B |
1 |
1 |
16686 |
◊ |
[SCN]C:609 |
y,x-1,-z |
4_545 |
1 |
1 |
177 |
5.5 |
-0.0 |
0.441 |
0 |
0 |
0 |
0.000 |
40 |
58 |
|
[GOL]B:608 |
2 |
1 |
222 |
◊ |
[SCN]C:609 |
y,x-1,-z |
4_545 |
1 |
1 |
177 |
4.7 |
-0.2 |
0.624 |
0 |
0 |
0 |
0.000 |
|