## |
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 |
154 |
38 |
12793 |
◊ |
A |
x,y,z |
1_555 |
152 |
38 |
12842 |
1426.6 |
-4.4 |
0.503 |
26 |
19 |
0 |
0.112 |
2 |
2 |
|
A |
54 |
17 |
12842 |
x |
A |
-x-1/2,y-1/2,-z |
4_445 |
48 |
13 |
12842 |
494.1 |
-0.3 |
0.557 |
4 |
6 |
0 |
0.000 |
3 |
3 |
|
B |
46 |
10 |
12793 |
◊ |
A |
-x,y,-z+1 |
2_556 |
47 |
12 |
12842 |
430.9 |
0.1 |
0.633 |
5 |
1 |
0 |
0.000 |
4 |
4 |
|
B |
44 |
12 |
12793 |
◊ |
B |
-x,y,-z |
2_555 |
44 |
12 |
12793 |
403.9 |
-1.3 |
0.503 |
10 |
8 |
0 |
0.000 |
5 |
5 |
|
B |
18 |
8 |
12793 |
◊ |
B |
-x,y,-z+1 |
2_556 |
18 |
8 |
12793 |
186.7 |
-0.5 |
0.537 |
2 |
4 |
0 |
0.000 |
6 |
6 |
|
[CAC]B:404 |
5 |
1 |
235 |
f |
B |
x,y,z |
1_555 |
25 |
13 |
12793 |
117.9 |
1.1 |
0.147 |
0 |
0 |
0 |
0.000 |
7 |
|
[CAC]A:405 |
5 |
1 |
235 |
f |
A |
x,y,z |
1_555 |
28 |
13 |
12842 |
115.4 |
0.9 |
0.141 |
0 |
0 |
0 |
0.000 |
Average: |
116.7 |
1.0 |
0.144 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[EDO]A:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
12842 |
85.4 |
2.7 |
0.609 |
1 |
0 |
0 |
0.000 |
8 |
9 |
|
[EDO]B:405 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
12793 |
83.4 |
2.4 |
0.424 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
B |
10 |
4 |
12793 |
◊ |
A |
-x,y,-z |
2_555 |
10 |
4 |
12842 |
74.6 |
0.2 |
0.642 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
A |
10 |
3 |
12842 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
12793 |
57.6 |
1.5 |
0.763 |
2 |
0 |
0 |
0.000 |
11 |
12 |
|
[FMT]A:401 |
3 |
1 |
151 |
cf |
A |
x,y,z |
1_555 |
10 |
7 |
12842 |
48.4 |
-0.4 |
0.342 |
2 |
0 |
0 |
0.008 |
12 |
13 |
|
[FMT]B:401 |
3 |
1 |
151 |
cf |
B |
x,y,z |
1_555 |
9 |
8 |
12793 |
47.9 |
-0.4 |
0.339 |
3 |
0 |
0 |
0.010 |
13 |
14 |
|
[CAC]B:404 |
4 |
1 |
235 |
f |
[EDO]B:405 |
x,y,z |
1_555 |
3 |
1 |
184 |
34.4 |
1.6 |
0.230 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[CAC]A:405 |
4 |
1 |
235 |
f |
[EDO]A:404 |
x,y,z |
1_555 |
4 |
1 |
183 |
33.0 |
1.4 |
0.322 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
[ZN]B:403 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
12793 |
30.8 |
-19.5 |
0.000 |
0 |
0 |
0 |
0.236 |
17 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
12842 |
30.1 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.236 |
Average: |
30.5 |
-19.9 |
0.000 |
0 |
0 |
0 |
0.236 |
16 |
18 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
12842 |
26.8 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.216 |
19 |
|
[ZN]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
12793 |
26.2 |
-18.0 |
0.000 |
0 |
0 |
0 |
0.216 |
Average: |
26.5 |
-18.2 |
0.000 |
0 |
0 |
0 |
0.216 |
17 |
20 |
|
[CAC]B:404 |
4 |
1 |
235 |
f |
[FMT]B:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
26.6 |
0.6 |
0.101 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[CAC]A:405 |
4 |
1 |
235 |
f |
[FMT]A:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
26.1 |
0.6 |
0.101 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
A |
4 |
2 |
12842 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
6 |
2 |
12793 |
22.1 |
0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[CAC]B:404 |
4 |
1 |
235 |
f |
[ZN]B:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.5 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.107 |
24 |
|
[CAC]A:405 |
3 |
1 |
235 |
f |
[ZN]A:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.107 |
Average: |
21.4 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.107 |
21 |
25 |
|
[CAC]A:405 |
3 |
1 |
235 |
f |
[ZN]A:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.3 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.093 |
26 |
|
[CAC]B:404 |
3 |
1 |
235 |
f |
[ZN]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.093 |
Average: |
19.9 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.093 |
22 |
27 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
[FMT]A:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
18.7 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.091 |
28 |
|
[ZN]B:403 |
1 |
1 |
98 |
f |
[FMT]B:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
18.3 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.091 |
Average: |
18.5 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.091 |
23 |
29 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
[FMT]A:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
17.8 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.080 |
30 |
|
[ZN]B:402 |
1 |
1 |
98 |
f |
[FMT]B:401 |
x,y,z |
1_555 |
3 |
1 |
151 |
17.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.080 |
Average: |
17.5 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.080 |
24 |
31 |
|
[EDO]B:405 |
2 |
1 |
184 |
f |
[ZN]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.7 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.021 |
25 |
32 |
|
[EDO]A:404 |
2 |
1 |
183 |
f |
[ZN]A:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.9 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.018 |
26 |
33 |
|
[ZN]B:403 |
1 |
1 |
98 |
f |
[ZN]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.034 |
27 |
34 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
[ZN]A:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.033 |
28 |
35 |
|
[EDO]B:405 |
1 |
1 |
184 |
f |
[FMT]B:401 |
x,y,z |
1_555 |
1 |
1 |
151 |
4.2 |
0.2 |
0.577 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
[EDO]A:404 |
1 |
1 |
183 |
f |
[FMT]A:401 |
x,y,z |
1_555 |
1 |
1 |
151 |
2.1 |
0.0 |
0.577 |
0 |
0 |
0 |
0.000 |
|