## |
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 |
|
E |
250 |
64 |
15184 |
◊ |
D |
x,y,z |
1_555 |
245 |
63 |
15304 |
2493.4 |
-32.4 |
0.023 |
24 |
18 |
0 |
0.402 |
2 |
|
F |
241 |
63 |
15269 |
◊ |
A |
x,y,z |
1_555 |
248 |
63 |
15202 |
2460.3 |
-34.2 |
0.015 |
28 |
19 |
0 |
0.402 |
3 |
|
C |
250 |
64 |
15191 |
◊ |
B |
x,y,z |
1_555 |
254 |
66 |
15080 |
2458.9 |
-35.2 |
0.011 |
31 |
20 |
0 |
0.402 |
Average: |
2470.9 |
-33.9 |
0.017 |
28 |
19 |
0 |
0.402 |
2 |
4 |
|
F |
47 |
14 |
15269 |
◊ |
E |
-x+1/2,-y,z-1/2 |
2_554 |
45 |
15 |
15184 |
435.5 |
-1.8 |
0.578 |
2 |
3 |
0 |
0.000 |
5 |
|
B |
52 |
17 |
15080 |
◊ |
A |
x,y,z |
1_555 |
44 |
15 |
15202 |
423.4 |
-1.4 |
0.590 |
2 |
3 |
0 |
0.000 |
Average: |
429.5 |
-1.6 |
0.584 |
2 |
3 |
0 |
0.000 |
3 |
6 |
|
D |
37 |
13 |
15304 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
29 |
13 |
15191 |
318.3 |
-2.4 |
0.443 |
2 |
3 |
0 |
0.000 |
4 |
7 |
|
B |
31 |
10 |
15080 |
◊ |
D |
-x,y-1/2,-z+1/2 |
4_545 |
30 |
10 |
15304 |
296.7 |
-5.8 |
0.105 |
2 |
0 |
0 |
0.000 |
5 |
8 |
|
C |
28 |
10 |
15191 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
4_645 |
32 |
9 |
15184 |
269.7 |
-3.0 |
0.279 |
1 |
0 |
0 |
0.000 |
6 |
9 |
|
C |
23 |
6 |
15191 |
◊ |
A |
-x,y-1/2,-z+1/2 |
4_545 |
26 |
8 |
15202 |
223.4 |
0.3 |
0.706 |
0 |
1 |
0 |
0.000 |
7 |
10 |
|
A |
28 |
10 |
15202 |
x |
A |
x-1/2,-y-1/2,-z |
3_445 |
22 |
8 |
15202 |
212.9 |
-0.5 |
0.609 |
1 |
2 |
0 |
0.000 |
8 |
11 |
|
[PDC]C:402 |
12 |
1 |
315 |
f |
C |
x,y,z |
1_555 |
40 |
19 |
15191 |
204.3 |
1.3 |
0.198 |
4 |
0 |
0 |
0.004 |
9 |
12 |
|
B |
29 |
11 |
15080 |
◊ |
E |
-x,y-1/2,-z+1/2 |
4_545 |
21 |
7 |
15184 |
203.2 |
3.4 |
0.809 |
1 |
0 |
0 |
0.000 |
10 |
13 |
|
[PDC]E:402 |
12 |
1 |
318 |
f |
E |
x,y,z |
1_555 |
34 |
17 |
15184 |
201.1 |
2.1 |
0.260 |
3 |
0 |
0 |
0.000 |
11 |
14 |
|
[PDC]B:402 |
12 |
1 |
317 |
f |
B |
x,y,z |
1_555 |
32 |
16 |
15080 |
198.0 |
2.4 |
0.225 |
4 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
19 |
4 |
15080 |
x |
B |
-x,y-1/2,-z+1/2 |
4_545 |
26 |
7 |
15080 |
190.5 |
-1.2 |
0.515 |
0 |
1 |
0 |
0.000 |
13 |
16 |
|
[PDC]A:402 |
12 |
1 |
312 |
f |
A |
x,y,z |
1_555 |
30 |
15 |
15202 |
188.0 |
2.1 |
0.220 |
4 |
0 |
0 |
0.000 |
14 |
17 |
|
[PDC]F:402 |
12 |
1 |
306 |
f |
F |
x,y,z |
1_555 |
33 |
17 |
15269 |
187.9 |
2.4 |
0.274 |
3 |
0 |
0 |
0.000 |
15 |
18 |
|
[PDC]D:402 |
12 |
1 |
314 |
f |
D |
x,y,z |
1_555 |
28 |
13 |
15304 |
181.0 |
2.9 |
0.351 |
3 |
0 |
0 |
0.000 |
16 |
19 |
|
E |
18 |
4 |
15184 |
◊ |
B |
x,y,z |
1_555 |
15 |
8 |
15080 |
165.4 |
0.3 |
0.672 |
4 |
2 |
0 |
0.000 |
17 |
20 |
|
D |
21 |
6 |
15304 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
15202 |
156.0 |
-0.0 |
0.659 |
1 |
0 |
0 |
0.000 |
21 |
|
A |
17 |
6 |
15202 |
◊ |
D |
x-1,y,z |
1_455 |
15 |
5 |
15304 |
142.0 |
0.5 |
0.681 |
2 |
0 |
0 |
0.000 |
Average: |
149.0 |
0.3 |
0.670 |
2 |
0 |
0 |
0.000 |
18 |
22 |
|
F |
17 |
7 |
15269 |
◊ |
E |
x-1/2,-y-1/2,-z |
3_445 |
18 |
7 |
15184 |
138.6 |
-1.6 |
0.425 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
F |
13 |
3 |
15269 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
16 |
6 |
15191 |
129.6 |
0.1 |
0.666 |
1 |
3 |
0 |
0.000 |
20 |
24 |
|
C |
14 |
6 |
15191 |
◊ |
D |
-x,y-1/2,-z+1/2 |
4_545 |
14 |
8 |
15304 |
116.6 |
2.5 |
0.824 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
A |
14 |
3 |
15202 |
◊ |
D |
x-1/2,-y-1/2,-z |
3_445 |
16 |
4 |
15304 |
115.1 |
0.5 |
0.725 |
1 |
0 |
0 |
0.000 |
22 |
26 |
|
F |
11 |
7 |
15269 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
13 |
5 |
15202 |
106.3 |
0.0 |
0.668 |
2 |
0 |
0 |
0.000 |
23 |
27 |
|
C |
11 |
3 |
15191 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
14 |
4 |
15080 |
101.0 |
-0.4 |
0.572 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
A |
8 |
4 |
15202 |
◊ |
C |
-x,y-1/2,-z+1/2 |
4_545 |
9 |
2 |
15191 |
83.3 |
0.3 |
0.574 |
1 |
0 |
0 |
0.000 |
25 |
29 |
|
F |
13 |
5 |
15269 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
7 |
4 |
15304 |
77.6 |
1.3 |
0.834 |
1 |
1 |
0 |
0.000 |
26 |
30 |
|
F |
12 |
4 |
15269 |
◊ |
B |
x-1/2,-y-1/2,-z |
3_445 |
11 |
4 |
15080 |
73.0 |
1.8 |
0.864 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
E |
4 |
2 |
15184 |
x |
E |
-x+1,y-1/2,-z+1/2 |
4_645 |
5 |
2 |
15184 |
43.3 |
0.7 |
0.753 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
[ZN]C:401 |
1 |
1 |
98 |
cf |
C |
x,y,z |
1_555 |
5 |
4 |
15191 |
37.6 |
-29.8 |
0.000 |
0 |
0 |
0 |
0.467 |
33 |
|
[ZN]E:401 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
15184 |
37.3 |
-29.3 |
0.000 |
0 |
0 |
0 |
0.467 |
34 |
|
[ZN]F:401 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
8 |
5 |
15269 |
36.4 |
-28.6 |
0.000 |
0 |
0 |
0 |
0.467 |
35 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
3 |
15202 |
35.2 |
-27.2 |
0.000 |
0 |
0 |
0 |
0.467 |
36 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
15080 |
34.9 |
-27.2 |
0.000 |
0 |
0 |
0 |
0.467 |
37 |
|
[ZN]D:401 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
15304 |
34.3 |
-26.8 |
0.000 |
0 |
0 |
0 |
0.467 |
Average: |
35.9 |
-28.2 |
0.000 |
0 |
0 |
0 |
0.467 |
29 |
38 |
|
[PDC]D:402 |
4 |
1 |
314 |
f |
[ZN]D:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.102 |
30 |
39 |
|
[PDC]B:402 |
2 |
1 |
317 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.9 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.175 |
40 |
|
[PDC]A:402 |
2 |
1 |
312 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.2 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.175 |
41 |
|
[PDC]F:402 |
3 |
1 |
306 |
f |
[ZN]F:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.3 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.175 |
42 |
|
[PDC]C:402 |
2 |
1 |
315 |
f |
[ZN]C:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.175 |
43 |
|
[PDC]E:402 |
3 |
1 |
318 |
f |
[ZN]E:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.4 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.175 |
Average: |
26.6 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.175 |
31 |
44 |
|
[PDC]D:402 |
3 |
1 |
314 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
15184 |
22.1 |
0.7 |
0.336 |
1 |
0 |
0 |
0.000 |
32 |
45 |
|
[PDC]F:402 |
2 |
1 |
306 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
15202 |
17.7 |
0.0 |
0.237 |
1 |
0 |
0 |
0.003 |
46 |
|
[PDC]B:402 |
2 |
1 |
317 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
15191 |
8.8 |
0.5 |
0.410 |
0 |
0 |
0 |
0.003 |
Average: |
13.2 |
0.3 |
0.324 |
1 |
0 |
0 |
0.003 |
33 |
47 |
|
[PDC]A:402 |
3 |
1 |
312 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
15269 |
17.0 |
0.7 |
0.354 |
0 |
0 |
0 |
0.000 |
34 |
48 |
|
F |
1 |
1 |
15269 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
15304 |
15.3 |
0.0 |
0.372 |
0 |
0 |
0 |
0.000 |
35 |
49 |
|
[PDC]C:402 |
1 |
1 |
315 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
15080 |
14.6 |
0.5 |
0.540 |
0 |
0 |
0 |
0.000 |
36 |
50 |
|
[PDC]E:402 |
2 |
1 |
318 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
15304 |
7.5 |
0.4 |
0.374 |
0 |
0 |
0 |
0.000 |
37 |
51 |
|
A |
2 |
1 |
15202 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
15184 |
5.4 |
0.0 |
0.643 |
0 |
0 |
0 |
0.000 |
38 |
52 |
|
D |
1 |
1 |
15304 |
x |
D |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
15304 |
2.4 |
0.1 |
0.607 |
0 |
0 |
0 |
0.000 |
39 |
53 |
|
A |
1 |
1 |
15202 |
◊ |
F |
x-1/2,-y-1/2,-z |
3_445 |
3 |
2 |
15269 |
0.8 |
0.0 |
0.699 |
0 |
0 |
0 |
0.000 |
|