| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
48 |
13 |
7567 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
47 |
13 |
7567 |
426.6 |
0.2 |
0.626 |
2 |
0 |
0 |
0.000 |
2 |
|
C |
42 |
5 |
1556 |
◊ |
A |
x,y,z |
1_555 |
46 |
13 |
7567 |
390.5 |
-2.6 |
0.610 |
6 |
0 |
0 |
0.018 |
3 |
|
A |
42 |
12 |
7567 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
40 |
11 |
7567 |
336.1 |
2.1 |
0.721 |
1 |
5 |
0 |
0.000 |
4 |
|
b |
29 |
2 |
698 |
◊ |
A |
x,y,z |
1_555 |
38 |
15 |
7567 |
250.5 |
-5.9 |
0.301 |
5 |
0 |
0 |
0.037 |
5 |
|
B |
23 |
3 |
1030 |
◊ |
A |
x,y,z |
1_555 |
33 |
13 |
7567 |
220.1 |
-4.9 |
0.322 |
4 |
0 |
0 |
0.034 |
6 |
|
B |
19 |
4 |
1030 |
◊ |
C |
x,y,z |
1_555 |
21 |
5 |
1556 |
176.0 |
-2.7 |
0.508 |
8 |
0 |
0 |
0.070 |
7 |
|
[PGE]A:216 |
10 |
1 |
328 |
f |
A |
x,y,z |
1_555 |
22 |
5 |
7567 |
152.7 |
2.7 |
0.158 |
2 |
0 |
0 |
0.000 |
8 |
|
b |
16 |
2 |
698 |
◊ |
C |
x,y,z |
1_555 |
17 |
3 |
1556 |
126.6 |
0.2 |
0.705 |
6 |
0 |
0 |
0.007 |
9 |
|
A |
12 |
3 |
7567 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
13 |
5 |
7567 |
120.2 |
-0.0 |
0.540 |
1 |
1 |
0 |
0.000 |
10 |
|
[GOL]A:215 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
7567 |
119.5 |
-0.3 |
0.508 |
2 |
0 |
0 |
0.006 |
11 |
|
[GOL]A:214 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
7567 |
107.1 |
-0.9 |
0.403 |
1 |
0 |
0 |
0.007 |
12 |
|
[GOL]A:213 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
20 |
5 |
7567 |
102.1 |
-0.9 |
0.383 |
1 |
0 |
0 |
0.007 |
13 |
|
[EDO]A:211 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
7567 |
99.5 |
3.5 |
0.677 |
3 |
0 |
0 |
0.000 |
14 |
|
[PGE]A:216 |
9 |
1 |
328 |
◊ |
B |
x,y,z |
1_555 |
14 |
3 |
1030 |
94.4 |
0.2 |
0.095 |
1 |
0 |
0 |
0.001 |
15 |
|
C |
13 |
1 |
1556 |
x |
C |
-x+1/2,y-1/2,-z |
4_545 |
12 |
1 |
1556 |
93.1 |
2.0 |
0.745 |
0 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:208 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
7567 |
92.9 |
2.7 |
0.278 |
3 |
0 |
0 |
0.000 |
17 |
|
[K]A:203 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
7567 |
91.0 |
-69.7 |
0.000 |
0 |
0 |
0 |
0.358 |
18 |
|
b |
13 |
1 |
698 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
13 |
1 |
1030 |
90.9 |
3.3 |
0.868 |
0 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:210 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
7567 |
88.2 |
1.5 |
0.194 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:209 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
13 |
3 |
1556 |
83.9 |
2.1 |
0.277 |
2 |
0 |
0 |
0.000 |
21 |
|
[GOL]A:212 |
6 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
7567 |
83.4 |
0.4 |
0.635 |
1 |
0 |
0 |
0.000 |
22 |
|
[K]C:101 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
1556 |
81.5 |
-51.4 |
0.000 |
0 |
0 |
0 |
0.572 |
23 |
|
[IOD]A:204 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
7567 |
80.5 |
0.1 |
0.754 |
0 |
0 |
0 |
0.000 |
24 |
|
[K]A:217 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
7567 |
79.0 |
-48.2 |
0.000 |
0 |
0 |
0 |
0.247 |
25 |
|
b |
15 |
1 |
698 |
◊ |
B |
x,y,z |
1_555 |
12 |
1 |
1030 |
71.1 |
-0.2 |
0.660 |
1 |
0 |
0 |
0.003 |
26 |
|
[IOD]A:205 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
7567 |
70.1 |
-0.5 |
0.579 |
0 |
0 |
0 |
0.002 |
27 |
|
[GOL]C:102 |
4 |
1 |
212 |
◊ |
C |
x,y,z |
1_555 |
11 |
2 |
1556 |
69.6 |
1.4 |
0.743 |
3 |
0 |
0 |
0.000 |
28 |
|
[IOD]A:206 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
7567 |
68.4 |
-0.5 |
0.515 |
0 |
0 |
0 |
0.003 |
29 |
|
[K]C:101 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
1030 |
61.3 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.358 |
30 |
|
[GOL]C:102 |
5 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
7567 |
58.3 |
-0.1 |
0.610 |
3 |
0 |
0 |
0.007 |
31 |
|
[GOL]A:213 |
6 |
1 |
216 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
7 |
3 |
7567 |
56.8 |
0.4 |
0.644 |
1 |
0 |
0 |
0.000 |
32 |
|
[GOL]A:212 |
4 |
1 |
219 |
f |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
7 |
2 |
7567 |
50.8 |
-0.0 |
0.578 |
1 |
0 |
0 |
0.003 |
33 |
|
[K]A:217 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
9 |
1 |
1030 |
49.4 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.133 |
34 |
|
[K]A:203 |
1 |
1 |
216 |
◊ |
b |
x,y,z |
1_555 |
9 |
2 |
698 |
48.2 |
-26.4 |
0.000 |
0 |
0 |
0 |
0.120 |
35 |
|
[IOD]A:207 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7567 |
47.5 |
-0.1 |
0.691 |
0 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:209 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
7567 |
44.2 |
1.1 |
0.632 |
0 |
0 |
0 |
0.000 |
37 |
|
C |
6 |
1 |
1556 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
6 |
1 |
1030 |
42.4 |
0.5 |
0.620 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
5 |
2 |
7567 |
f |
[IOD]A:207 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
144 |
41.9 |
-0.3 |
0.541 |
0 |
0 |
0 |
0.002 |
39 |
|
[GOL]A:215 |
3 |
1 |
220 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
7567 |
36.1 |
0.7 |
0.793 |
2 |
0 |
0 |
0.000 |
40 |
|
[GOL]A:213 |
3 |
1 |
216 |
◊ |
[GOL]A:212 |
x,y,z |
1_555 |
3 |
1 |
219 |
35.9 |
0.5 |
0.632 |
2 |
0 |
0 |
0.000 |
41 |
|
[GOL]C:102 |
3 |
1 |
212 |
◊ |
b |
x,y,z |
1_555 |
6 |
2 |
698 |
35.6 |
-0.5 |
0.521 |
0 |
0 |
0 |
0.002 |
42 |
|
[GOL]A:215 |
2 |
1 |
220 |
cf |
[EDO]A:211 |
x,y,z |
1_555 |
3 |
1 |
186 |
35.4 |
0.9 |
0.866 |
0 |
0 |
0 |
0.000 |
43 |
|
[K]A:217 |
1 |
1 |
216 |
◊ |
b |
x,y,z |
1_555 |
5 |
1 |
698 |
34.2 |
-17.5 |
0.000 |
0 |
0 |
0 |
0.080 |
44 |
|
[PGE]A:216 |
2 |
1 |
328 |
f |
[IOD]A:205 |
x,y,z |
1_555 |
1 |
1 |
144 |
33.1 |
0.6 |
0.458 |
0 |
0 |
0 |
0.000 |
45 |
|
A |
5 |
2 |
7567 |
◊ |
[K]C:101 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
216 |
32.8 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.069 |
46 |
|
[IOD]A:206 |
1 |
1 |
144 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
4 |
2 |
7567 |
28.7 |
-0.3 |
0.574 |
0 |
0 |
0 |
0.000 |
47 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7567 |
27.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.018 |
48 |
|
[MG]A:202 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
7567 |
24.9 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.023 |
49 |
|
[GOL]A:212 |
2 |
1 |
219 |
◊ |
[IOD]A:204 |
x,y,z |
1_555 |
1 |
1 |
144 |
24.6 |
-0.1 |
0.764 |
0 |
0 |
0 |
0.000 |
50 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
b |
x,y,z |
1_555 |
5 |
2 |
698 |
21.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.015 |
51 |
|
[MG]A:202 |
1 |
1 |
98 |
◊ |
b |
x,y,z |
1_555 |
4 |
1 |
698 |
18.6 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.012 |
52 |
|
b |
3 |
1 |
698 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
1556 |
18.5 |
-0.9 |
0.421 |
0 |
0 |
0 |
0.003 |
53 |
|
[K]A:203 |
1 |
1 |
216 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.3 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.054 |
54 |
|
A |
5 |
2 |
7567 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
1030 |
16.2 |
0.5 |
0.624 |
0 |
0 |
0 |
0.000 |
55 |
|
[MG]A:202 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
1030 |
15.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.006 |
56 |
|
[K]A:217 |
1 |
1 |
216 |
f |
[MG]A:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.037 |
57 |
|
[K]A:217 |
1 |
1 |
216 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.5 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.037 |
58 |
|
C |
2 |
1 |
1556 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
2 |
1 |
7567 |
11.4 |
0.2 |
0.466 |
0 |
0 |
0 |
0.000 |
59 |
|
[GOL]C:102 |
2 |
1 |
212 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
1030 |
9.4 |
-0.2 |
0.533 |
0 |
0 |
0 |
0.000 |
60 |
|
[K]A:217 |
1 |
1 |
216 |
f |
[K]A:203 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.3 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.048 |
61 |
|
[GOL]A:214 |
2 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
1556 |
9.3 |
-0.5 |
0.323 |
0 |
0 |
0 |
0.002 |
62 |
|
[MG]A:202 |
1 |
1 |
98 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.008 |
63 |
|
[PGE]A:216 |
1 |
1 |
328 |
f |
[K]A:217 |
x,y,z |
1_555 |
1 |
1 |
216 |
4.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
64 |
|
[IOD]A:204 |
1 |
1 |
144 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
7567 |
1.7 |
0.0 |
0.829 |
0 |
0 |
0 |
0.000 |
|