## |
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 |
913 |
229 |
52216 |
◊ |
A |
x,y,z |
1_555 |
964 |
260 |
71315 |
9338.2 |
-86.7 |
0.037 |
133 |
34 |
0 |
0.608 |
2 |
|
G |
234 |
60 |
9982 |
◊ |
D |
x,y,z |
1_555 |
225 |
59 |
11917 |
2201.2 |
-21.6 |
0.223 |
23 |
13 |
0 |
1.000 |
3 |
|
K |
197 |
48 |
8673 |
◊ |
C |
x,y,z |
1_555 |
203 |
54 |
16370 |
2082.6 |
-33.0 |
0.027 |
14 |
9 |
0 |
1.000 |
4 |
|
E |
206 |
48 |
12961 |
◊ |
A |
x,y,z |
1_555 |
226 |
66 |
71315 |
2070.5 |
-12.7 |
0.298 |
23 |
9 |
0 |
0.271 |
5 |
|
F |
211 |
54 |
5656 |
◊ |
A |
x,y,z |
1_555 |
221 |
54 |
71315 |
1955.1 |
-19.6 |
0.270 |
20 |
7 |
0 |
0.249 |
6 |
|
C |
185 |
46 |
16370 |
◊ |
B |
x,y,z |
1_555 |
182 |
46 |
52216 |
1712.4 |
-7.7 |
0.542 |
25 |
11 |
0 |
0.507 |
7 |
|
I |
169 |
43 |
9568 |
◊ |
A |
x,y,z |
1_555 |
178 |
47 |
71315 |
1625.5 |
-11.9 |
0.325 |
26 |
7 |
0 |
0.206 |
8 |
|
J |
142 |
31 |
5006 |
◊ |
B |
x,y,z |
1_555 |
183 |
55 |
52216 |
1534.6 |
-17.8 |
0.194 |
17 |
5 |
0 |
0.974 |
9 |
|
H |
156 |
37 |
8510 |
◊ |
A |
x,y,z |
1_555 |
143 |
44 |
71315 |
1456.7 |
-17.9 |
0.067 |
19 |
6 |
0 |
0.229 |
10 |
|
I |
154 |
36 |
9568 |
◊ |
B |
x,y,z |
1_555 |
146 |
38 |
52216 |
1388.7 |
-14.8 |
0.178 |
9 |
3 |
0 |
0.965 |
11 |
|
X |
121 |
32 |
8669 |
◊ |
A |
x,y,z |
1_555 |
138 |
37 |
71315 |
1249.6 |
-13.6 |
0.361 |
9 |
2 |
0 |
0.228 |
12 |
|
J |
101 |
26 |
5006 |
◊ |
C |
x,y,z |
1_555 |
119 |
38 |
16370 |
1103.6 |
-3.6 |
0.659 |
19 |
5 |
0 |
1.000 |
13 |
|
L |
94 |
23 |
4490 |
◊ |
B |
x,y,z |
1_555 |
125 |
39 |
52216 |
1086.7 |
-1.6 |
0.713 |
19 |
12 |
0 |
0.944 |
14 |
|
K |
106 |
25 |
8673 |
◊ |
A |
x,y,z |
1_555 |
108 |
28 |
71315 |
981.3 |
-9.7 |
0.352 |
10 |
3 |
0 |
0.186 |
15 |
|
P |
93 |
8 |
2857 |
◊ |
A |
x,y,z |
1_555 |
91 |
28 |
71315 |
795.7 |
-8.9 |
0.839 |
13 |
0 |
0 |
0.186 |
16 |
|
G |
76 |
21 |
9982 |
◊ |
G |
-x+1,y,-z-1/2 |
3_654 |
76 |
21 |
9982 |
795.7 |
-11.1 |
0.154 |
1 |
0 |
0 |
0.000 |
17 |
|
T |
76 |
8 |
3253 |
◊ |
A |
x,y,z |
1_555 |
76 |
24 |
71315 |
675.4 |
-3.0 |
0.830 |
9 |
0 |
0 |
0.000 |
18 |
|
G |
75 |
19 |
9982 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
71315 |
605.5 |
-10.8 |
0.054 |
5 |
5 |
0 |
0.176 |
19 |
|
L |
49 |
8 |
4490 |
◊ |
C |
x,y,z |
1_555 |
70 |
19 |
16370 |
553.1 |
-1.7 |
0.564 |
11 |
6 |
0 |
0.075 |
20 |
|
I |
58 |
14 |
9568 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
56 |
16 |
71315 |
507.1 |
0.2 |
0.610 |
11 |
3 |
0 |
0.000 |
21 |
|
P |
50 |
9 |
2857 |
◊ |
B |
x,y,z |
1_555 |
58 |
23 |
52216 |
500.0 |
-5.2 |
0.780 |
5 |
0 |
0 |
0.024 |
22 |
|
G |
49 |
15 |
9982 |
◊ |
F |
x,y,z |
1_555 |
41 |
17 |
5656 |
469.5 |
-5.1 |
0.327 |
3 |
1 |
0 |
0.000 |
23 |
|
K |
48 |
15 |
8673 |
◊ |
B |
x,y,z |
1_555 |
52 |
16 |
52216 |
467.2 |
-1.6 |
0.690 |
3 |
4 |
0 |
0.034 |
24 |
|
T |
45 |
9 |
3253 |
◊ |
N |
x,y,z |
1_555 |
44 |
10 |
2581 |
438.8 |
-7.0 |
0.545 |
27 |
0 |
0 |
1.000 |
25 |
|
C |
37 |
9 |
16370 |
◊ |
A |
x,-y,-z |
4_555 |
38 |
9 |
71315 |
369.1 |
-0.5 |
0.632 |
8 |
1 |
0 |
0.000 |
26 |
|
C |
38 |
10 |
16370 |
◊ |
A |
x,y,z |
1_555 |
34 |
11 |
71315 |
337.6 |
-3.1 |
0.377 |
3 |
0 |
0 |
0.016 |
27 |
|
D |
37 |
12 |
11917 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
38 |
13 |
71315 |
327.8 |
4.6 |
0.945 |
4 |
6 |
0 |
0.000 |
28 |
|
N |
33 |
6 |
2581 |
◊ |
A |
x,y,z |
1_555 |
33 |
14 |
71315 |
288.1 |
-6.4 |
0.360 |
3 |
0 |
0 |
0.000 |
29 |
|
K |
22 |
7 |
8673 |
◊ |
H |
x,y,z |
1_555 |
21 |
6 |
8510 |
214.5 |
-2.0 |
0.455 |
0 |
0 |
0 |
0.005 |
30 |
|
T |
27 |
5 |
3253 |
◊ |
B |
x,y,z |
1_555 |
31 |
14 |
52216 |
211.4 |
-7.7 |
0.254 |
0 |
0 |
0 |
0.000 |
31 |
|
P |
20 |
5 |
2857 |
◊ |
T |
x,y,z |
1_555 |
21 |
4 |
3253 |
197.8 |
-3.2 |
0.654 |
13 |
0 |
0 |
0.000 |
32 |
|
H |
16 |
5 |
8510 |
◊ |
C |
x,y,z |
1_555 |
22 |
5 |
16370 |
167.5 |
-1.8 |
0.359 |
0 |
0 |
0 |
0.005 |
33 |
|
X |
17 |
6 |
8669 |
◊ |
E |
x,y,z |
1_555 |
16 |
6 |
12961 |
163.9 |
-0.1 |
0.675 |
1 |
0 |
0 |
0.007 |
34 |
|
F |
22 |
7 |
5656 |
◊ |
E |
x,y,z |
1_555 |
13 |
5 |
12961 |
156.9 |
0.4 |
0.656 |
1 |
2 |
0 |
0.003 |
35 |
|
D |
15 |
6 |
11917 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
52216 |
139.1 |
-2.1 |
0.375 |
1 |
0 |
0 |
0.000 |
36 |
|
[BRU]T:22 |
14 |
1 |
460 |
cf |
T |
x,y,z |
1_555 |
13 |
1 |
3253 |
115.3 |
2.6 |
0.719 |
0 |
0 |
0 |
0.000 |
37 |
|
[BRU]T:22 |
7 |
1 |
460 |
◊ |
B |
x,y,z |
1_555 |
15 |
8 |
52216 |
107.9 |
-2.6 |
0.277 |
2 |
0 |
0 |
0.000 |
38 |
|
L |
14 |
5 |
4490 |
◊ |
B |
x,-y,-z |
4_555 |
15 |
8 |
52216 |
101.8 |
-1.0 |
0.486 |
1 |
0 |
0 |
0.000 |
39 |
|
G |
9 |
4 |
9982 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
52216 |
95.8 |
-0.6 |
0.458 |
2 |
0 |
0 |
0.004 |
40 |
|
F |
13 |
5 |
5656 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
52216 |
90.8 |
-0.6 |
0.576 |
0 |
0 |
0 |
0.002 |
41 |
|
L |
9 |
5 |
4490 |
◊ |
J |
x,y,z |
1_555 |
7 |
2 |
5006 |
80.6 |
-0.4 |
0.438 |
1 |
0 |
0 |
0.009 |
42 |
|
D |
8 |
4 |
11917 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
71315 |
72.2 |
-2.0 |
0.207 |
0 |
0 |
0 |
0.000 |
43 |
|
L |
11 |
5 |
4490 |
◊ |
L |
x,-y,-z |
4_555 |
11 |
5 |
4490 |
70.7 |
1.4 |
0.770 |
0 |
0 |
0 |
0.000 |
44 |
|
C |
9 |
3 |
16370 |
◊ |
B |
x,-y,-z |
4_555 |
7 |
4 |
52216 |
68.9 |
0.8 |
0.744 |
1 |
0 |
0 |
0.000 |
45 |
|
E |
6 |
2 |
12961 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
52216 |
51.0 |
-1.4 |
0.192 |
0 |
0 |
0 |
0.005 |
46 |
|
[MG]A:2458 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
71315 |
37.4 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.063 |
47 |
|
[MG]A:2458 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
8 |
2 |
2857 |
35.4 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.058 |
48 |
|
[BRU]T:22 |
6 |
1 |
460 |
◊ |
P |
x,y,z |
1_555 |
5 |
1 |
2857 |
31.5 |
0.0 |
0.539 |
1 |
0 |
0 |
0.000 |
49 |
|
N |
2 |
1 |
2581 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
52216 |
30.6 |
-1.5 |
0.160 |
0 |
0 |
0 |
0.000 |
50 |
|
L |
2 |
1 |
4490 |
◊ |
K |
x,y,z |
1_555 |
3 |
2 |
8673 |
18.0 |
0.0 |
0.580 |
0 |
0 |
0 |
0.000 |
51 |
|
G |
1 |
1 |
9982 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
3 |
2 |
71315 |
16.3 |
0.4 |
0.827 |
0 |
0 |
0 |
0.000 |
52 |
|
[ZN]C:1269 |
1 |
1 |
98 |
f |
A |
x,-y,-z |
4_555 |
1 |
1 |
71315 |
13.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.064 |
53 |
|
G |
3 |
2 |
9982 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
3 |
2 |
52216 |
11.7 |
0.2 |
0.739 |
0 |
0 |
0 |
0.000 |
54 |
|
[ZN]B:2225 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
71315 |
7.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.039 |
55 |
|
B |
1 |
1 |
52216 |
◊ |
B |
x,-y,-z |
4_555 |
1 |
1 |
52216 |
6.1 |
0.2 |
0.841 |
0 |
0 |
0 |
0.000 |
56 |
|
[ZN]A:2457 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
52216 |
1.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.056 |
57 |
|
H |
1 |
1 |
8510 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
52216 |
0.8 |
0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|