| ## |
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 |
|
B |
911 |
225 |
53645 |
◊ |
A |
x,y,z |
1_555 |
952 |
255 |
70245 |
8990.1 |
-101.3 |
0.001 |
109 |
28 |
0 |
0.509 |
2 |
|
E |
215 |
47 |
13115 |
◊ |
A |
x,y,z |
1_555 |
234 |
70 |
70245 |
2078.0 |
-13.0 |
0.231 |
23 |
8 |
0 |
0.277 |
3 |
|
K |
201 |
47 |
8533 |
◊ |
C |
x,y,z |
1_555 |
211 |
54 |
16498 |
2032.4 |
-34.5 |
0.019 |
9 |
5 |
0 |
1.000 |
4 |
|
F |
191 |
48 |
5955 |
◊ |
A |
x,y,z |
1_555 |
184 |
48 |
70245 |
1720.9 |
-16.1 |
0.237 |
13 |
3 |
0 |
0.357 |
5 |
|
C |
195 |
46 |
16498 |
◊ |
B |
x,y,z |
1_555 |
180 |
47 |
53645 |
1652.1 |
-5.6 |
0.455 |
27 |
11 |
0 |
0.339 |
6 |
|
I |
165 |
41 |
9613 |
◊ |
A |
x,y,z |
1_555 |
167 |
40 |
70245 |
1550.0 |
-15.5 |
0.114 |
22 |
6 |
0 |
0.224 |
7 |
|
J |
145 |
32 |
4968 |
◊ |
B |
x,y,z |
1_555 |
176 |
54 |
53645 |
1509.4 |
-20.2 |
0.095 |
14 |
4 |
0 |
0.418 |
8 |
|
H |
152 |
37 |
8858 |
◊ |
A |
x,y,z |
1_555 |
145 |
45 |
70245 |
1468.0 |
-19.0 |
0.032 |
14 |
4 |
0 |
0.227 |
9 |
|
I |
151 |
36 |
9613 |
◊ |
B |
x,y,z |
1_555 |
156 |
39 |
53645 |
1392.8 |
-13.0 |
0.174 |
6 |
2 |
0 |
0.180 |
10 |
|
J |
107 |
29 |
4968 |
◊ |
C |
x,y,z |
1_555 |
124 |
37 |
16498 |
1102.7 |
-3.7 |
0.630 |
15 |
7 |
0 |
0.120 |
11 |
|
L |
95 |
25 |
4672 |
◊ |
B |
x,y,z |
1_555 |
116 |
34 |
53645 |
1010.8 |
-0.6 |
0.640 |
18 |
11 |
0 |
0.093 |
12 |
|
K |
101 |
25 |
8533 |
◊ |
A |
x,y,z |
1_555 |
103 |
27 |
70245 |
961.1 |
-10.1 |
0.288 |
5 |
3 |
0 |
0.099 |
13 |
|
D |
85 |
8 |
3259 |
◊ |
A |
x,y,z |
1_555 |
83 |
22 |
70245 |
699.9 |
0.1 |
0.891 |
7 |
0 |
0 |
0.008 |
14 |
|
D |
77 |
10 |
3259 |
◊ |
B |
x,y,z |
1_555 |
76 |
28 |
53645 |
653.1 |
-12.1 |
0.301 |
9 |
0 |
0 |
0.220 |
15 |
|
L |
49 |
8 |
4672 |
◊ |
C |
x,y,z |
1_555 |
72 |
18 |
16498 |
532.0 |
0.5 |
0.678 |
10 |
7 |
0 |
0.045 |
16 |
|
A |
61 |
15 |
70245 |
◊ |
I |
-x+1/2,y-1/2,-z+1 |
4_546 |
49 |
13 |
9613 |
498.5 |
-0.0 |
0.513 |
8 |
2 |
0 |
0.000 |
17 |
|
K |
47 |
15 |
8533 |
◊ |
B |
x,y,z |
1_555 |
52 |
17 |
53645 |
468.8 |
-1.7 |
0.641 |
4 |
4 |
0 |
0.029 |
18 |
|
R |
56 |
9 |
2182 |
◊ |
D |
x,y,z |
1_555 |
53 |
10 |
3259 |
452.5 |
-4.0 |
0.676 |
21 |
0 |
0 |
0.112 |
19 |
|
R |
48 |
8 |
2182 |
◊ |
B |
x,y,z |
1_555 |
50 |
23 |
53645 |
426.2 |
-9.0 |
0.469 |
7 |
0 |
0 |
0.101 |
20 |
|
E |
50 |
15 |
13115 |
◊ |
E |
-x+1,y,-z+1 |
2_656 |
50 |
15 |
13115 |
402.7 |
-0.3 |
0.557 |
2 |
0 |
0 |
0.000 |
21 |
|
C |
38 |
9 |
16498 |
◊ |
A |
-x,y,-z |
2_555 |
39 |
10 |
70245 |
361.0 |
-1.2 |
0.548 |
7 |
2 |
0 |
0.000 |
22 |
|
C |
43 |
9 |
16498 |
◊ |
A |
x,y,z |
1_555 |
38 |
12 |
70245 |
349.6 |
-1.1 |
0.558 |
3 |
0 |
0 |
0.007 |
23 |
|
I |
39 |
10 |
9613 |
◊ |
B |
-x,y,-z+1 |
2_556 |
32 |
12 |
53645 |
315.0 |
-2.9 |
0.337 |
2 |
1 |
0 |
0.000 |
24 |
|
L |
32 |
10 |
4672 |
◊ |
L |
-x,y,-z |
2_555 |
32 |
10 |
4672 |
309.2 |
0.8 |
0.641 |
2 |
0 |
0 |
0.000 |
25 |
|
I |
29 |
7 |
9613 |
◊ |
I |
-x,y,-z+1 |
2_556 |
29 |
7 |
9613 |
298.0 |
0.7 |
0.662 |
2 |
0 |
0 |
0.000 |
26 |
|
R |
34 |
5 |
2182 |
◊ |
A |
x,y,z |
1_555 |
32 |
14 |
70245 |
286.5 |
-0.3 |
0.846 |
2 |
0 |
0 |
0.004 |
27 |
|
L |
23 |
6 |
4672 |
◊ |
B |
-x,y,-z |
2_555 |
26 |
10 |
53645 |
214.3 |
-0.7 |
0.465 |
2 |
1 |
0 |
0.000 |
28 |
|
K |
24 |
7 |
8533 |
◊ |
H |
x,y,z |
1_555 |
21 |
6 |
8858 |
201.6 |
-2.0 |
0.470 |
0 |
0 |
0 |
0.015 |
29 |
|
H |
19 |
6 |
8858 |
◊ |
C |
x,y,z |
1_555 |
25 |
6 |
16498 |
186.0 |
-0.8 |
0.530 |
2 |
1 |
0 |
0.005 |
30 |
|
F |
14 |
5 |
5955 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
13115 |
120.3 |
-0.3 |
0.540 |
1 |
3 |
0 |
0.014 |
31 |
|
C |
13 |
6 |
16498 |
◊ |
B |
-x,y,-z |
2_555 |
13 |
5 |
53645 |
117.3 |
0.8 |
0.733 |
2 |
0 |
0 |
0.000 |
32 |
|
H |
14 |
5 |
8858 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
9 |
3 |
53645 |
84.5 |
-0.2 |
0.570 |
1 |
0 |
0 |
0.000 |
33 |
|
L |
5 |
3 |
4672 |
◊ |
J |
x,y,z |
1_555 |
5 |
2 |
4968 |
52.2 |
-0.3 |
0.459 |
0 |
0 |
0 |
0.003 |
34 |
|
[ZN]A:1734 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
70245 |
49.0 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.626 |
35 |
|
[ZN]B:1307 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
53645 |
48.6 |
-37.5 |
0.000 |
0 |
0 |
0 |
0.661 |
36 |
|
F |
8 |
2 |
5955 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
53645 |
47.7 |
-0.4 |
0.521 |
0 |
0 |
0 |
0.001 |
37 |
|
[MG]R:10 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
70245 |
37.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.014 |
38 |
|
[MG]R:10 |
1 |
1 |
98 |
f |
R |
x,y,z |
1_555 |
6 |
2 |
2182 |
34.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.100 |
39 |
|
L |
2 |
1 |
4672 |
◊ |
K |
x,y,z |
1_555 |
3 |
2 |
8533 |
16.9 |
-0.0 |
0.585 |
0 |
0 |
0 |
0.000 |
40 |
|
H |
1 |
1 |
8858 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
53645 |
9.0 |
0.2 |
0.574 |
0 |
0 |
0 |
0.000 |
41 |
|
[ZN]B:1307 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
70245 |
4.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.006 |
42 |
|
[ZN]C:319 |
1 |
1 |
98 |
f |
A |
-x,y,-z |
2_555 |
2 |
1 |
70245 |
2.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.017 |
|