## |
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 |
386 |
76 |
211212 |
◊ |
L |
x,y,z |
1_555 |
310 |
77 |
9109 |
3266.8 |
-63.3 |
0.814 |
72 |
0 |
0 |
0.156 |
2 |
|
A |
358 |
60 |
211212 |
◊ |
D |
x,y,z |
1_555 |
293 |
77 |
12154 |
2982.5 |
-51.2 |
0.823 |
80 |
0 |
0 |
0.153 |
3 |
|
A |
347 |
63 |
211212 |
◊ |
I |
x,y,z |
1_555 |
267 |
58 |
8342 |
2920.7 |
-48.7 |
0.856 |
67 |
0 |
0 |
0.152 |
4 |
|
A |
324 |
59 |
211212 |
◊ |
Q |
x,y,z |
1_555 |
250 |
57 |
7750 |
2635.7 |
-38.7 |
0.840 |
55 |
0 |
0 |
0.134 |
5 |
|
A |
290 |
51 |
211212 |
◊ |
P |
x,y,z |
1_555 |
248 |
55 |
5470 |
2490.7 |
-44.3 |
0.688 |
46 |
0 |
0 |
0.134 |
6 |
|
A |
294 |
59 |
211212 |
◊ |
T |
x,y,z |
1_555 |
242 |
62 |
7058 |
2440.5 |
-58.4 |
0.539 |
46 |
0 |
0 |
0.148 |
7 |
|
A |
247 |
42 |
211212 |
◊ |
M |
x,y,z |
1_555 |
203 |
52 |
9605 |
2176.6 |
-40.7 |
0.713 |
40 |
0 |
0 |
0.128 |
8 |
|
A |
249 |
44 |
211212 |
◊ |
G |
x,y,z |
1_555 |
175 |
47 |
10401 |
1982.6 |
-26.9 |
0.907 |
46 |
0 |
0 |
0.135 |
9 |
|
A |
228 |
39 |
211212 |
◊ |
E |
x,y,z |
1_555 |
191 |
54 |
8545 |
1943.9 |
-34.8 |
0.708 |
46 |
0 |
0 |
0.121 |
10 |
|
A |
249 |
47 |
211212 |
◊ |
N |
x,y,z |
1_555 |
172 |
35 |
5730 |
1859.7 |
-30.2 |
0.898 |
47 |
0 |
0 |
0.133 |
11 |
|
A |
230 |
42 |
211212 |
◊ |
H |
x,y,z |
1_555 |
191 |
52 |
8380 |
1827.3 |
-32.7 |
0.281 |
30 |
0 |
0 |
0.167 |
12 |
|
A |
216 |
42 |
211212 |
◊ |
K |
x,y,z |
1_555 |
171 |
43 |
7434 |
1807.9 |
-33.5 |
0.671 |
31 |
0 |
0 |
0.145 |
13 |
|
A |
209 |
41 |
211212 |
◊ |
O |
x,y,z |
1_555 |
179 |
43 |
6450 |
1775.9 |
-34.1 |
0.707 |
40 |
0 |
0 |
0.128 |
14 |
|
A |
223 |
44 |
211212 |
◊ |
J |
x,y,z |
1_555 |
177 |
43 |
7715 |
1774.6 |
-37.5 |
0.741 |
33 |
0 |
0 |
0.119 |
15 |
|
A |
199 |
39 |
211212 |
◊ |
C |
x,y,z |
1_555 |
160 |
45 |
12004 |
1705.7 |
-33.5 |
0.544 |
23 |
0 |
0 |
0.159 |
16 |
|
A |
216 |
39 |
211212 |
◊ |
S |
x,y,z |
1_555 |
161 |
28 |
6015 |
1608.1 |
-20.7 |
0.945 |
32 |
0 |
0 |
0.127 |
17 |
|
A |
152 |
32 |
211212 |
◊ |
V |
x,y,z |
1_555 |
122 |
23 |
2394 |
1300.1 |
-28.1 |
0.432 |
33 |
0 |
0 |
0.156 |
18 |
|
A |
160 |
26 |
211212 |
x |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
178 |
30 |
211212 |
1201.9 |
-24.5 |
0.978 |
11 |
0 |
0 |
0.000 |
19 |
|
R |
108 |
28 |
5648 |
◊ |
F |
x,y,z |
1_555 |
109 |
26 |
6848 |
1028.8 |
-7.1 |
0.187 |
15 |
3 |
0 |
0.052 |
20 |
|
A |
118 |
27 |
211212 |
◊ |
B |
x,y,z |
1_555 |
93 |
29 |
12442 |
916.9 |
-16.0 |
0.755 |
16 |
0 |
0 |
0.084 |
21 |
|
A |
100 |
21 |
211212 |
◊ |
R |
x,y,z |
1_555 |
88 |
20 |
5648 |
883.2 |
-20.0 |
0.508 |
17 |
0 |
0 |
0.100 |
22 |
|
N |
84 |
21 |
5730 |
◊ |
C |
x,y,z |
1_555 |
96 |
23 |
12004 |
838.6 |
-8.0 |
0.221 |
4 |
0 |
0 |
0.025 |
23 |
|
N |
86 |
19 |
5730 |
◊ |
J |
x,y,z |
1_555 |
91 |
18 |
7715 |
800.8 |
-8.9 |
0.256 |
9 |
6 |
0 |
1.000 |
24 |
|
H |
65 |
20 |
8380 |
◊ |
E |
x,y,z |
1_555 |
63 |
16 |
8545 |
607.6 |
-0.7 |
0.504 |
7 |
4 |
0 |
0.010 |
25 |
|
A |
68 |
13 |
211212 |
◊ |
F |
x,y,z |
1_555 |
59 |
19 |
6848 |
574.7 |
-7.9 |
0.764 |
11 |
0 |
0 |
0.047 |
26 |
|
A |
62 |
14 |
211212 |
◊ |
M |
-y+1/2,x-1/2,z+1/4 |
3_545 |
52 |
15 |
9605 |
473.0 |
-9.7 |
0.576 |
4 |
0 |
0 |
0.000 |
27 |
|
[PAR]A:1785 |
33 |
1 |
739 |
f |
A |
x,y,z |
1_555 |
61 |
14 |
211212 |
455.8 |
-17.5 |
0.650 |
9 |
0 |
0 |
0.078 |
28 |
|
J |
46 |
13 |
7715 |
◊ |
C |
x,y,z |
1_555 |
43 |
12 |
12004 |
400.3 |
-3.0 |
0.393 |
1 |
0 |
0 |
0.008 |
29 |
|
B |
37 |
15 |
12442 |
◊ |
B |
y,x,-z |
7_555 |
37 |
15 |
12442 |
372.7 |
7.1 |
0.969 |
4 |
2 |
0 |
0.000 |
30 |
|
S |
43 |
12 |
6015 |
◊ |
M |
x,y,z |
1_555 |
33 |
12 |
9605 |
332.9 |
-5.3 |
0.180 |
2 |
0 |
0 |
0.010 |
31 |
|
W |
38 |
4 |
1130 |
◊ |
A |
x,y,z |
1_555 |
36 |
10 |
211212 |
291.8 |
-4.7 |
0.795 |
4 |
0 |
0 |
0.000 |
32 |
|
R |
33 |
8 |
5648 |
◊ |
K |
x,y,z |
1_555 |
36 |
10 |
7434 |
287.4 |
-1.9 |
0.448 |
5 |
2 |
0 |
0.013 |
33 |
|
E |
31 |
12 |
8545 |
◊ |
D |
x,y,z |
1_555 |
32 |
12 |
12154 |
276.6 |
0.6 |
0.548 |
0 |
2 |
0 |
0.000 |
34 |
|
E |
34 |
12 |
8545 |
◊ |
E |
y,x,-z |
7_555 |
34 |
12 |
8545 |
257.8 |
3.9 |
0.843 |
4 |
0 |
0 |
0.000 |
35 |
|
H |
25 |
8 |
8380 |
◊ |
B |
x,y,z |
1_555 |
32 |
8 |
12442 |
253.8 |
-0.7 |
0.521 |
3 |
2 |
0 |
0.008 |
36 |
|
I |
20 |
8 |
8342 |
◊ |
G |
x,y,z |
1_555 |
27 |
7 |
10401 |
249.2 |
-2.0 |
0.279 |
3 |
0 |
0 |
0.006 |
37 |
|
X |
28 |
4 |
1369 |
◊ |
A |
x,y,z |
1_555 |
32 |
6 |
211212 |
248.6 |
-2.3 |
0.826 |
3 |
0 |
0 |
0.000 |
38 |
|
H |
25 |
10 |
8380 |
◊ |
D |
y,x,-z |
7_555 |
34 |
14 |
12154 |
228.4 |
2.7 |
0.478 |
2 |
2 |
0 |
0.000 |
39 |
|
J |
20 |
5 |
7715 |
◊ |
J |
-y+1,-x+1,-z+1/2 |
8_665 |
20 |
5 |
7715 |
210.6 |
3.0 |
0.861 |
4 |
6 |
0 |
0.000 |
40 |
|
K |
27 |
8 |
7434 |
◊ |
G |
x,y,z |
1_555 |
25 |
6 |
10401 |
206.6 |
-2.4 |
0.318 |
2 |
0 |
0 |
0.009 |
41 |
|
Q |
21 |
5 |
7750 |
◊ |
L |
x,y,z |
1_555 |
21 |
6 |
9109 |
192.3 |
-3.5 |
0.181 |
0 |
0 |
0 |
0.006 |
42 |
|
J |
23 |
8 |
7715 |
◊ |
I |
x,y,z |
1_555 |
17 |
4 |
8342 |
167.7 |
-0.8 |
0.356 |
0 |
0 |
0 |
0.001 |
43 |
|
X |
22 |
3 |
1369 |
◊ |
W |
x,y,z |
1_555 |
21 |
3 |
1130 |
166.5 |
3.2 |
0.914 |
2 |
0 |
0 |
0.000 |
44 |
|
K |
22 |
9 |
7434 |
◊ |
A |
x,y,z-1 |
1_554 |
21 |
3 |
211212 |
165.0 |
-1.2 |
0.736 |
1 |
0 |
0 |
0.000 |
45 |
|
Q |
18 |
6 |
7750 |
◊ |
H |
x,y,z |
1_555 |
14 |
4 |
8380 |
134.8 |
-0.6 |
0.476 |
1 |
0 |
0 |
0.002 |
46 |
|
[RSQ]X:34 |
16 |
1 |
463 |
cf |
X |
x,y,z |
1_555 |
15 |
1 |
1369 |
122.0 |
1.5 |
0.779 |
0 |
0 |
0 |
0.000 |
47 |
|
[RSQ]X:34 |
15 |
1 |
463 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
211212 |
113.0 |
-0.3 |
0.723 |
0 |
0 |
0 |
0.000 |
48 |
|
A |
11 |
2 |
211212 |
◊ |
G |
-y+1/2,x-1/2,z+1/4 |
3_545 |
10 |
2 |
10401 |
98.1 |
-2.6 |
0.425 |
1 |
0 |
0 |
0.000 |
49 |
|
A |
12 |
4 |
211212 |
◊ |
I |
-y+1/2,x-1/2,z+1/4 |
3_545 |
10 |
3 |
8342 |
93.6 |
-2.9 |
0.461 |
1 |
0 |
0 |
0.000 |
50 |
|
[RSQ]X:34 |
8 |
1 |
463 |
◊ |
W |
x,y,z |
1_555 |
9 |
3 |
1130 |
70.6 |
1.9 |
0.771 |
1 |
0 |
0 |
0.000 |
51 |
|
E |
7 |
2 |
8545 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
12004 |
68.9 |
1.1 |
0.672 |
0 |
1 |
0 |
0.000 |
52 |
|
N |
14 |
3 |
5730 |
◊ |
I |
x,y,z |
1_555 |
8 |
2 |
8342 |
68.8 |
-0.1 |
0.571 |
0 |
0 |
0 |
0.000 |
53 |
|
A |
7 |
2 |
211212 |
◊ |
M |
x-1/2,-y+1/2,-z-1/4 |
6_454 |
7 |
3 |
9605 |
65.6 |
-2.0 |
0.360 |
0 |
0 |
0 |
0.000 |
54 |
|
L |
7 |
2 |
9109 |
◊ |
H |
x,y,z |
1_555 |
8 |
2 |
8380 |
59.1 |
-0.9 |
0.336 |
0 |
0 |
0 |
0.000 |
55 |
|
D |
3 |
1 |
12154 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
12004 |
53.0 |
1.1 |
0.750 |
0 |
0 |
0 |
0.000 |
56 |
|
V |
4 |
3 |
2394 |
◊ |
M |
x,y,z |
1_555 |
7 |
4 |
9605 |
42.2 |
0.3 |
0.515 |
0 |
0 |
0 |
0.000 |
57 |
|
W |
5 |
2 |
1130 |
◊ |
L |
x,y,z |
1_555 |
6 |
2 |
9109 |
34.9 |
-1.7 |
0.359 |
0 |
0 |
0 |
0.000 |
58 |
|
A |
6 |
2 |
211212 |
◊ |
K |
-y+1/2,x-1/2,z+1/4 |
3_545 |
2 |
1 |
7434 |
31.6 |
0.9 |
0.810 |
0 |
0 |
0 |
0.000 |
59 |
|
O |
2 |
1 |
6450 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6848 |
31.0 |
0.6 |
0.409 |
0 |
0 |
0 |
0.000 |
60 |
|
[ZN]N:101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
211212 |
14.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.022 |
61 |
|
E |
1 |
1 |
8545 |
◊ |
B |
y,x,-z |
7_555 |
1 |
1 |
12442 |
5.9 |
0.1 |
0.550 |
0 |
0 |
0 |
0.000 |
62 |
|
G |
2 |
2 |
10401 |
◊ |
G |
-y+1,-x+1,-z-1/2 |
8_664 |
2 |
2 |
10401 |
4.5 |
0.3 |
0.735 |
0 |
0 |
0 |
0.000 |
63 |
|
A |
1 |
1 |
211212 |
◊ |
D |
y,x,-z |
7_555 |
1 |
1 |
12154 |
3.5 |
-0.2 |
0.312 |
0 |
0 |
0 |
0.000 |
64 |
|
Q |
1 |
1 |
7750 |
◊ |
O |
x,y,z |
1_555 |
1 |
1 |
6450 |
2.9 |
0.1 |
0.633 |
0 |
0 |
0 |
0.000 |
65 |
|
C |
2 |
2 |
12004 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
12442 |
1.4 |
0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
|