## |
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 |
|
C |
199 |
51 |
7344 |
◊ |
B |
x,y,z |
1_555 |
210 |
50 |
6274 |
2019.3 |
-35.3 |
0.119 |
15 |
0 |
0 |
0.604 |
2 |
|
B |
83 |
17 |
6274 |
◊ |
A |
x,y,z |
1_555 |
89 |
26 |
9135 |
868.1 |
-6.9 |
0.465 |
10 |
9 |
0 |
0.141 |
3 |
|
D |
72 |
16 |
2324 |
◊ |
B |
x,y,z |
1_555 |
69 |
18 |
6274 |
715.9 |
-5.9 |
0.629 |
11 |
3 |
0 |
0.316 |
4 |
|
C |
52 |
12 |
7344 |
◊ |
A |
x,y,z |
1_555 |
56 |
17 |
9135 |
486.7 |
-5.2 |
0.459 |
7 |
0 |
0 |
0.057 |
5 |
|
A |
39 |
14 |
9135 |
◊ |
C |
-x+1,-x+y,-z-1/3 |
6_654 |
45 |
11 |
7344 |
390.0 |
0.9 |
0.811 |
9 |
12 |
0 |
0.080 |
6 |
|
A |
32 |
9 |
9135 |
x |
A |
-y+1,x-y,z-1/3 |
2_654 |
34 |
13 |
9135 |
337.8 |
-1.5 |
0.542 |
1 |
4 |
0 |
0.000 |
7 |
|
D |
20 |
6 |
2324 |
◊ |
C |
y,x,-z |
4_555 |
21 |
7 |
7344 |
235.6 |
-2.0 |
0.545 |
1 |
4 |
0 |
0.020 |
8 |
|
D |
31 |
8 |
2324 |
◊ |
A |
y,x,-z |
4_555 |
23 |
5 |
9135 |
211.0 |
-2.6 |
0.467 |
3 |
0 |
0 |
0.035 |
9 |
|
D |
11 |
4 |
2324 |
◊ |
D |
y,x,-z |
4_555 |
11 |
4 |
2324 |
109.9 |
-3.5 |
0.150 |
0 |
0 |
0 |
0.016 |
10 |
|
A |
6 |
2 |
9135 |
◊ |
C |
-y+1,x-y,z-1/3 |
2_654 |
12 |
5 |
7344 |
95.4 |
-0.9 |
0.472 |
1 |
0 |
0 |
0.008 |
11 |
|
D |
7 |
2 |
2324 |
◊ |
B |
y,x,-z |
4_555 |
11 |
4 |
6274 |
94.4 |
-2.0 |
0.241 |
0 |
0 |
0 |
0.018 |
12 |
|
B |
11 |
2 |
6274 |
◊ |
B |
-x,-x+y,-z-1/3 |
6_554 |
11 |
2 |
6274 |
91.5 |
0.3 |
0.749 |
4 |
0 |
0 |
0.000 |
13 |
|
[MPD]A:204 |
5 |
1 |
279 |
◊ |
B |
-x+1,-x+y,-z-1/3 |
6_654 |
12 |
4 |
6274 |
82.4 |
-4.8 |
0.808 |
0 |
0 |
0 |
0.034 |
14 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
9135 |
70.6 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.192 |
15 |
|
[ACE]D:121 |
3 |
1 |
170 |
cf |
D |
x,y,z |
1_555 |
9 |
4 |
2324 |
70.0 |
-0.2 |
0.861 |
2 |
0 |
0 |
0.100 |
16 |
|
[CL]A:202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
9135 |
68.6 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.176 |
17 |
|
[CL]A:203 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
9135 |
64.9 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.154 |
18 |
|
D |
6 |
3 |
2324 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
7344 |
64.5 |
-0.8 |
0.452 |
1 |
0 |
0 |
0.015 |
19 |
|
[MPD]A:204 |
4 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
9135 |
63.7 |
-3.9 |
0.651 |
0 |
0 |
0 |
0.064 |
20 |
|
[CL]B:203 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
6274 |
58.1 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.252 |
21 |
|
[CL]B:204 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
6274 |
56.2 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.219 |
22 |
|
[CL]B:201 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
6274 |
55.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.057 |
23 |
|
A |
9 |
4 |
9135 |
f |
[CL]C:201 |
-x+1,-x+y,-z-1/3 |
6_654 |
1 |
1 |
125 |
54.0 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.114 |
24 |
|
[MPD]A:204 |
4 |
1 |
279 |
◊ |
C |
-x+1,-x+y,-z-1/3 |
6_654 |
5 |
1 |
7344 |
50.7 |
-1.9 |
0.929 |
0 |
0 |
0 |
0.031 |
25 |
|
C |
3 |
2 |
7344 |
◊ |
C |
y,x,-z |
4_555 |
2 |
2 |
7344 |
47.3 |
-1.5 |
0.122 |
0 |
0 |
0 |
0.005 |
26 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
6274 |
45.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.164 |
27 |
|
[CL]C:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
7344 |
45.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.091 |
28 |
|
C |
5 |
2 |
7344 |
◊ |
B |
-x,-x+y,-z-1/3 |
6_554 |
4 |
2 |
6274 |
45.1 |
0.4 |
0.604 |
0 |
0 |
0 |
0.000 |
29 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
9135 |
44.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.097 |
30 |
|
[CL]B:202 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
7344 |
41.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.070 |
31 |
|
[ACE]D:121 |
3 |
1 |
170 |
◊ |
D |
y,x,-z |
4_555 |
3 |
2 |
2324 |
37.0 |
-0.6 |
0.687 |
0 |
0 |
0 |
0.006 |
32 |
|
B |
3 |
1 |
6274 |
◊ |
A |
y,x,-z |
4_555 |
3 |
1 |
9135 |
33.3 |
-1.1 |
0.220 |
0 |
0 |
0 |
0.009 |
33 |
|
D |
2 |
1 |
2324 |
◊ |
D |
-x,-x+y,-z-1/3 |
6_554 |
2 |
1 |
2324 |
27.6 |
0.2 |
0.724 |
1 |
0 |
0 |
0.000 |
34 |
|
[ACE]D:121 |
3 |
1 |
170 |
◊ |
[ACE]D:121 |
y,x,-z |
4_555 |
3 |
1 |
170 |
25.7 |
-0.5 |
0.852 |
0 |
0 |
0 |
0.002 |
35 |
|
[MPD]A:204 |
3 |
1 |
279 |
◊ |
[CL]B:202 |
-x+1,-x+y,-z-1/3 |
6_654 |
1 |
1 |
125 |
22.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.023 |
36 |
|
A |
1 |
1 |
9135 |
◊ |
B |
-x+1,-x+y,-z-1/3 |
6_654 |
2 |
1 |
6274 |
19.9 |
-0.6 |
0.205 |
0 |
0 |
0 |
0.004 |
37 |
|
[ACE]D:121 |
2 |
1 |
170 |
◊ |
B |
y,x,-z |
4_555 |
1 |
1 |
6274 |
17.5 |
-0.0 |
0.882 |
0 |
0 |
0 |
0.000 |
38 |
|
[MPD]A:204 |
2 |
1 |
279 |
◊ |
[CL]B:204 |
-x+1,-x+y,-z-1/3 |
6_654 |
1 |
1 |
125 |
14.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.015 |
39 |
|
[CL]A:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
7344 |
8.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.006 |
40 |
|
[CL]B:204 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
2324 |
7.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.019 |
41 |
|
C |
3 |
2 |
7344 |
◊ |
B |
y,x,-z |
4_555 |
2 |
2 |
6274 |
7.4 |
-0.3 |
0.528 |
0 |
0 |
0 |
0.002 |
42 |
|
D |
2 |
2 |
2324 |
◊ |
C |
-x,-x+y,-z-1/3 |
6_554 |
2 |
1 |
7344 |
2.5 |
-0.1 |
0.618 |
0 |
0 |
0 |
0.000 |
43 |
|
[CL]B:203 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9135 |
1.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
44 |
|
[CL]A:203 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6274 |
1.7 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
45 |
|
[CL]B:204 |
1 |
1 |
125 |
◊ |
A |
y,x,-z |
4_555 |
1 |
1 |
9135 |
1.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
46 |
|
[CL]B:203 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7344 |
1.0 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.002 |
|