## |
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 |
939 |
234 |
54470 |
◊ |
A |
x,y,z |
1_555 |
975 |
260 |
72763 |
9388.1 |
-99.0 |
0.004 |
115 |
25 |
0 |
0.558 |
2 |
2 |
|
E |
219 |
50 |
13732 |
◊ |
A |
x,y,z |
1_555 |
239 |
71 |
72763 |
2142.1 |
-16.4 |
0.183 |
25 |
9 |
0 |
0.232 |
3 |
3 |
|
K |
205 |
47 |
8864 |
◊ |
C |
x,y,z |
1_555 |
206 |
55 |
16853 |
2092.6 |
-35.7 |
0.019 |
14 |
5 |
0 |
1.000 |
4 |
4 |
|
F |
179 |
44 |
6367 |
◊ |
A |
x,y,z |
1_555 |
194 |
50 |
72763 |
1763.7 |
-20.4 |
0.190 |
9 |
3 |
0 |
0.577 |
5 |
5 |
|
C |
193 |
44 |
16853 |
◊ |
B |
x,y,z |
1_555 |
190 |
48 |
54470 |
1703.6 |
-6.7 |
0.607 |
20 |
10 |
0 |
0.284 |
6 |
6 |
|
I |
171 |
42 |
9462 |
◊ |
A |
x,y,z |
1_555 |
175 |
43 |
72763 |
1609.6 |
-16.1 |
0.161 |
21 |
3 |
0 |
0.274 |
7 |
7 |
|
J |
144 |
33 |
4957 |
◊ |
B |
x,y,z |
1_555 |
183 |
55 |
54470 |
1536.0 |
-22.6 |
0.078 |
11 |
2 |
0 |
0.910 |
8 |
8 |
|
H |
161 |
38 |
8977 |
◊ |
A |
x,y,z |
1_555 |
160 |
49 |
72763 |
1496.4 |
-20.0 |
0.043 |
12 |
2 |
0 |
0.373 |
9 |
9 |
|
I |
144 |
36 |
9462 |
◊ |
B |
x,y,z |
1_555 |
148 |
37 |
54470 |
1385.6 |
-10.2 |
0.304 |
8 |
3 |
0 |
0.143 |
10 |
10 |
|
J |
104 |
27 |
4957 |
◊ |
C |
x,y,z |
1_555 |
122 |
35 |
16853 |
1107.9 |
-6.5 |
0.572 |
12 |
5 |
0 |
1.000 |
11 |
11 |
|
L |
90 |
24 |
4659 |
◊ |
B |
x,y,z |
1_555 |
112 |
34 |
54470 |
991.0 |
-5.5 |
0.459 |
15 |
8 |
0 |
0.116 |
12 |
12 |
|
K |
100 |
27 |
8864 |
◊ |
A |
x,y,z |
1_555 |
98 |
27 |
72763 |
919.0 |
-10.1 |
0.269 |
7 |
2 |
0 |
0.426 |
13 |
13 |
|
T |
84 |
11 |
6568 |
◊ |
A |
x,y,z |
1_555 |
87 |
27 |
72763 |
732.0 |
-1.7 |
0.769 |
5 |
0 |
0 |
0.011 |
14 |
14 |
|
N |
78 |
13 |
3332 |
◊ |
T |
x,y,z |
1_555 |
61 |
15 |
6568 |
648.9 |
-10.4 |
0.598 |
21 |
0 |
0 |
1.000 |
15 |
15 |
|
T |
71 |
11 |
6568 |
◊ |
B |
x,y,z |
1_555 |
83 |
29 |
54470 |
641.2 |
-13.0 |
0.257 |
9 |
0 |
0 |
0.199 |
16 |
16 |
|
L |
49 |
8 |
4659 |
◊ |
C |
x,y,z |
1_555 |
76 |
21 |
16853 |
545.8 |
-1.4 |
0.554 |
9 |
4 |
0 |
0.045 |
17 |
17 |
|
A |
53 |
14 |
72763 |
◊ |
I |
-x+1/2,y-1/2,-z+1 |
4_546 |
54 |
15 |
9462 |
484.1 |
-1.1 |
0.565 |
6 |
0 |
0 |
0.000 |
18 |
18 |
|
R |
49 |
8 |
2337 |
◊ |
B |
x,y,z |
1_555 |
69 |
29 |
54470 |
476.9 |
-10.4 |
0.523 |
10 |
0 |
0 |
0.174 |
19 |
19 |
|
K |
45 |
15 |
8864 |
◊ |
B |
x,y,z |
1_555 |
55 |
16 |
54470 |
437.6 |
-1.3 |
0.691 |
3 |
1 |
0 |
0.026 |
20 |
20 |
|
R |
45 |
9 |
2337 |
◊ |
T |
x,y,z |
1_555 |
50 |
10 |
6568 |
414.7 |
-4.6 |
0.587 |
21 |
0 |
0 |
1.000 |
21 |
21 |
|
C |
45 |
9 |
16853 |
◊ |
A |
x,y,z |
1_555 |
37 |
14 |
72763 |
379.0 |
-4.3 |
0.289 |
2 |
0 |
0 |
0.014 |
22 |
22 |
|
C |
38 |
9 |
16853 |
◊ |
A |
-x,y,-z |
2_555 |
45 |
13 |
72763 |
357.0 |
-2.2 |
0.514 |
5 |
1 |
0 |
0.000 |
23 |
23 |
|
R |
34 |
5 |
2337 |
◊ |
A |
x,y,z |
1_555 |
34 |
13 |
72763 |
240.4 |
0.7 |
0.891 |
4 |
0 |
0 |
0.003 |
24 |
24 |
|
I |
26 |
7 |
9462 |
◊ |
I |
-x,y,-z+1 |
2_556 |
27 |
7 |
9462 |
233.3 |
0.5 |
0.695 |
4 |
0 |
0 |
0.000 |
25 |
25 |
|
L |
24 |
8 |
4659 |
◊ |
L |
-x,y,-z |
2_555 |
24 |
8 |
4659 |
222.6 |
0.3 |
0.634 |
2 |
0 |
0 |
0.000 |
26 |
26 |
|
L |
25 |
6 |
4659 |
◊ |
B |
-x,y,-z |
2_555 |
26 |
9 |
54470 |
221.2 |
-1.1 |
0.389 |
1 |
0 |
0 |
0.000 |
27 |
27 |
|
E |
25 |
5 |
13732 |
◊ |
E |
-x+1,y,-z+1 |
2_656 |
25 |
5 |
13732 |
207.1 |
-1.8 |
0.413 |
0 |
6 |
0 |
0.000 |
28 |
28 |
|
I |
25 |
5 |
9462 |
◊ |
B |
-x,y,-z+1 |
2_556 |
26 |
10 |
54470 |
200.0 |
-1.6 |
0.475 |
0 |
0 |
0 |
0.000 |
29 |
29 |
|
K |
19 |
7 |
8864 |
◊ |
H |
x,y,z |
1_555 |
18 |
5 |
8977 |
199.4 |
0.3 |
0.677 |
2 |
1 |
0 |
0.009 |
30 |
30 |
|
[G2P]T:3000 |
22 |
1 |
627 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
72763 |
171.9 |
-1.2 |
0.636 |
2 |
0 |
0 |
0.066 |
31 |
31 |
|
H |
15 |
5 |
8977 |
◊ |
C |
x,y,z |
1_555 |
20 |
5 |
16853 |
168.3 |
-1.7 |
0.369 |
0 |
0 |
0 |
0.004 |
32 |
32 |
|
N |
20 |
5 |
3332 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
72763 |
153.0 |
-1.9 |
0.573 |
0 |
0 |
0 |
0.005 |
33 |
33 |
|
F |
14 |
5 |
6367 |
◊ |
E |
x,y,z |
1_555 |
10 |
3 |
13732 |
110.7 |
-0.1 |
0.595 |
2 |
1 |
0 |
0.009 |
34 |
34 |
|
[G2P]T:3000 |
18 |
1 |
627 |
◊ |
R |
x,y,z |
1_555 |
15 |
1 |
2337 |
104.4 |
0.9 |
0.792 |
0 |
0 |
0 |
0.000 |
35 |
35 |
|
T |
16 |
2 |
6568 |
◊ |
T |
-x+1,y,-z+1 |
2_656 |
16 |
2 |
6568 |
103.7 |
2.4 |
0.780 |
0 |
0 |
0 |
0.000 |
36 |
36 |
|
[G2P]T:3000 |
11 |
1 |
627 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
54470 |
96.1 |
-0.1 |
0.594 |
3 |
0 |
0 |
0.005 |
37 |
37 |
|
N |
10 |
2 |
3332 |
◊ |
E |
x,y,z |
1_555 |
10 |
5 |
13732 |
91.8 |
-5.2 |
0.157 |
0 |
0 |
0 |
0.012 |
38 |
38 |
|
[G2P]T:3000 |
6 |
1 |
627 |
◊ |
T |
x,y,z |
1_555 |
9 |
2 |
6568 |
75.4 |
0.3 |
0.598 |
3 |
0 |
0 |
0.003 |
39 |
39 |
|
F |
9 |
4 |
6367 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
54470 |
62.0 |
-0.4 |
0.579 |
0 |
0 |
0 |
0.001 |
40 |
40 |
|
C |
6 |
3 |
16853 |
◊ |
B |
-x,y,-z |
2_555 |
8 |
3 |
54470 |
57.7 |
0.5 |
0.730 |
0 |
0 |
0 |
0.000 |
41 |
41 |
|
L |
5 |
3 |
4659 |
◊ |
J |
x,y,z |
1_555 |
6 |
2 |
4957 |
55.2 |
-0.2 |
0.525 |
0 |
0 |
0 |
0.001 |
42 |
42 |
|
N |
4 |
1 |
3332 |
◊ |
T |
-x+1,y,-z+1 |
2_656 |
7 |
1 |
6568 |
50.9 |
0.8 |
0.670 |
1 |
0 |
0 |
0.000 |
43 |
43 |
|
[ZN]L:105 |
1 |
1 |
98 |
f |
L |
x,y,z |
1_555 |
4 |
3 |
4659 |
49.3 |
-38.9 |
0.000 |
0 |
0 |
0 |
0.339 |
44 |
44 |
|
[MG]A:2002 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
54470 |
34.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.010 |
45 |
|
[MG]A:2001 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54470 |
2.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
18.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.010 |
45 |
46 |
|
[MG]A:2001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
72763 |
31.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.124 |
46 |
47 |
|
T |
3 |
2 |
6568 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
13732 |
30.6 |
-1.4 |
0.241 |
0 |
0 |
0 |
0.003 |
47 |
48 |
|
[G2P]T:3000 |
8 |
1 |
627 |
f |
[MG]A:2002 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.105 |
48 |
49 |
|
[MG]A:2002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
72763 |
25.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.077 |
49 |
50 |
|
[G2P]T:3000 |
5 |
1 |
627 |
f |
[MG]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.104 |
50 |
51 |
|
[MG]A:2001 |
1 |
1 |
98 |
◊ |
R |
x,y,z |
1_555 |
4 |
1 |
2337 |
23.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.007 |
51 |
52 |
|
N |
2 |
2 |
3332 |
◊ |
N |
-x+1,y,-z+1 |
2_656 |
2 |
2 |
3332 |
17.3 |
0.3 |
0.567 |
0 |
0 |
0 |
0.000 |
52 |
53 |
|
H |
2 |
1 |
8977 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54470 |
16.9 |
0.1 |
0.338 |
0 |
0 |
0 |
0.000 |
53 |
54 |
|
L |
2 |
1 |
4659 |
◊ |
K |
x,y,z |
1_555 |
6 |
2 |
8864 |
15.7 |
0.2 |
0.708 |
0 |
0 |
0 |
0.000 |
54 |
55 |
|
B |
2 |
2 |
54470 |
◊ |
B |
-x,y,-z |
2_555 |
2 |
2 |
54470 |
11.0 |
0.4 |
0.818 |
0 |
0 |
0 |
0.000 |
55 |
56 |
|
[MG]A:2002 |
1 |
1 |
98 |
f |
[MG]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.061 |
56 |
57 |
|
[ZN]A:1735 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
54470 |
6.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.086 |
57 |
58 |
|
[ZN]C:319 |
1 |
1 |
98 |
f |
A |
-x,y,-z |
2_555 |
1 |
1 |
72763 |
2.6 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.038 |
58 |
59 |
|
N |
1 |
1 |
3332 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
54470 |
0.5 |
0.0 |
0.522 |
0 |
0 |
0 |
0.000 |
59 |
60 |
|
[MG]A:2002 |
1 |
1 |
98 |
◊ |
R |
x,y,z |
1_555 |
1 |
1 |
2337 |
0.3 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
60 |
61 |
|
[ZN]J:101 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
54470 |
0.2 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.003 |
|