| ## |
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 |
|
D |
149 |
44 |
22558 |
◊ |
C |
x,y,z |
1_555 |
148 |
43 |
22482 |
1374.5 |
-14.7 |
0.520 |
10 |
3 |
0 |
0.144 |
2 |
|
B |
147 |
46 |
22997 |
◊ |
A |
x,y,z |
1_555 |
151 |
46 |
23096 |
1366.3 |
-13.0 |
0.495 |
13 |
4 |
0 |
0.144 |
| Average: |
1370.4 |
-13.9 |
0.508 |
12 |
4 |
0 |
0.144 |
| 2 |
3 |
|
A |
39 |
14 |
23096 |
◊ |
B |
x-1/2,-y-1/2,-z |
3_445 |
37 |
11 |
22997 |
359.1 |
-6.6 |
0.151 |
0 |
0 |
0 |
0.000 |
| 3 |
4 |
|
A |
37 |
13 |
23096 |
◊ |
C |
-x-3/2,-y,z-1/2 |
2_354 |
34 |
12 |
22482 |
332.0 |
-3.5 |
0.428 |
3 |
0 |
0 |
0.000 |
| 4 |
5 |
|
D |
37 |
13 |
22558 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
4_445 |
38 |
14 |
23096 |
320.3 |
-1.7 |
0.703 |
2 |
2 |
0 |
0.000 |
| 5 |
6 |
|
C |
27 |
9 |
22482 |
◊ |
A |
x,y,z |
1_555 |
25 |
8 |
23096 |
269.4 |
-5.4 |
0.123 |
0 |
0 |
0 |
0.000 |
7 |
|
D |
30 |
12 |
22558 |
◊ |
B |
x,y,z |
1_555 |
27 |
12 |
22997 |
266.9 |
-5.2 |
0.216 |
0 |
0 |
0 |
0.000 |
| Average: |
268.1 |
-5.3 |
0.170 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[BPV]A:1102 |
7 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
23 |
14 |
23096 |
171.6 |
4.6 |
0.678 |
7 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[BPV]C:1102 |
6 |
1 |
213 |
f |
C |
x,y,z |
1_555 |
19 |
13 |
22482 |
136.1 |
5.6 |
0.671 |
6 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[BPV]B:1103 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
21 |
14 |
22997 |
134.8 |
5.3 |
0.775 |
6 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[BPV]D:1102 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
19 |
14 |
22558 |
134.7 |
5.5 |
0.783 |
6 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[GOL]B:1101 |
6 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
23096 |
84.6 |
0.0 |
0.637 |
4 |
0 |
0 |
0.013 |
| 11 |
13 |
|
[GOL]B:1101 |
6 |
1 |
214 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
22997 |
84.4 |
-0.7 |
0.527 |
2 |
0 |
0 |
0.012 |
| 12 |
14 |
|
[GOL]C:1105 |
6 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
13 |
6 |
22558 |
83.2 |
-0.7 |
0.539 |
2 |
0 |
0 |
0.012 |
| 13 |
15 |
|
[GOL]C:1105 |
6 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
22482 |
81.4 |
-0.1 |
0.634 |
4 |
0 |
0 |
0.014 |
| 14 |
16 |
|
[CL]A:1103 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
23096 |
67.7 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.153 |
17 |
|
[CL]C:1103 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
22482 |
67.4 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.153 |
18 |
|
[CL]B:1104 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
22997 |
66.3 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.153 |
19 |
|
[CL]D:1103 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
22558 |
65.8 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.153 |
| Average: |
66.8 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.153 |
| 15 |
20 |
|
A |
8 |
3 |
23096 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
10 |
6 |
22482 |
54.0 |
-0.0 |
0.681 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[MG]C:1104 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
22482 |
51.9 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.148 |
22 |
|
[MG]B:1105 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
22997 |
51.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.148 |
23 |
|
[MG]D:1104 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
22558 |
51.2 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.148 |
24 |
|
[MG]A:1104 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
23096 |
51.0 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.148 |
| Average: |
51.4 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.148 |
| 17 |
25 |
|
[ZN]C:1101 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
22482 |
43.9 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.494 |
26 |
|
[ZN]A:1101 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
23096 |
43.8 |
-34.3 |
0.000 |
0 |
0 |
0 |
0.494 |
27 |
|
[ZN]D:1101 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
3 |
3 |
22558 |
41.6 |
-32.9 |
0.000 |
0 |
0 |
0 |
0.494 |
28 |
|
[ZN]B:1102 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
5 |
3 |
22997 |
41.2 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.494 |
| Average: |
42.6 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.494 |
| 18 |
29 |
|
B |
2 |
1 |
22997 |
◊ |
C |
-x-1,y-1/2,-z+1/2 |
4_445 |
5 |
2 |
22482 |
16.6 |
-0.0 |
0.683 |
0 |
0 |
0 |
0.000 |
| 19 |
30 |
|
[BPV]B:1103 |
2 |
1 |
215 |
f |
[ZN]B:1102 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.080 |
31 |
|
[BPV]D:1102 |
2 |
1 |
218 |
f |
[ZN]D:1101 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.080 |
32 |
|
[BPV]C:1102 |
2 |
1 |
213 |
f |
[ZN]C:1101 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.080 |
33 |
|
[BPV]A:1102 |
2 |
1 |
259 |
f |
[ZN]A:1101 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.080 |
| Average: |
14.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.080 |
|