| ## |
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 |
|
A |
104 |
31 |
20344 |
◊ |
A |
x,-y+2,-z |
4_575 |
104 |
31 |
20344 |
1012.9 |
-23.2 |
0.066 |
2 |
0 |
0 |
0.000 |
2 |
|
A |
52 |
14 |
20344 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
52 |
14 |
20344 |
446.2 |
-5.8 |
0.680 |
2 |
0 |
0 |
0.000 |
3 |
|
A |
50 |
15 |
20344 |
x |
A |
x-1/2,y+1/2,z |
5_455 |
52 |
15 |
20344 |
417.3 |
-5.9 |
0.667 |
4 |
0 |
0 |
0.000 |
4 |
|
[ZMA]A:1201 |
25 |
1 |
553 |
f |
A |
x,y,z |
1_555 |
55 |
20 |
20344 |
377.8 |
4.3 |
0.573 |
4 |
0 |
0 |
0.000 |
5 |
|
[OLC]A:1212 |
18 |
1 |
526 |
◊ |
A |
x,y,z |
1_555 |
44 |
13 |
20344 |
315.2 |
1.2 |
0.426 |
2 |
0 |
0 |
0.000 |
6 |
|
[CLR]A:1204 |
20 |
1 |
623 |
f |
A |
x,y,z |
1_555 |
37 |
12 |
20344 |
295.9 |
0.3 |
0.378 |
1 |
0 |
0 |
0.000 |
7 |
|
[CLR]A:1203 |
22 |
1 |
619 |
f |
A |
x,y,z |
1_555 |
34 |
11 |
20344 |
251.2 |
-1.1 |
0.239 |
0 |
0 |
0 |
0.000 |
8 |
|
[OLA]A:1227 |
20 |
1 |
606 |
f |
A |
x,y,z |
1_555 |
38 |
9 |
20344 |
246.2 |
-0.3 |
0.283 |
0 |
0 |
0 |
0.000 |
9 |
|
[OLC]A:1209 |
16 |
1 |
482 |
f |
A |
x,y,z |
1_555 |
36 |
12 |
20344 |
239.0 |
-0.2 |
0.243 |
1 |
0 |
0 |
0.000 |
10 |
|
[OLC]A:1208 |
17 |
1 |
513 |
f |
A |
x,y,z |
1_555 |
31 |
11 |
20344 |
229.3 |
-0.1 |
0.193 |
2 |
0 |
0 |
0.000 |
11 |
|
[OLA]A:1213 |
11 |
1 |
371 |
◊ |
A |
x,y,z |
1_555 |
28 |
12 |
20344 |
216.5 |
4.5 |
0.083 |
0 |
0 |
0 |
0.000 |
12 |
|
[CLR]A:1205 |
21 |
1 |
622 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
20344 |
205.7 |
0.4 |
0.321 |
1 |
0 |
0 |
0.000 |
13 |
|
A |
21 |
9 |
20344 |
x |
A |
x-1,y,z |
1_455 |
26 |
8 |
20344 |
195.6 |
0.7 |
0.872 |
2 |
0 |
0 |
0.000 |
14 |
|
[OLA]A:1216 |
9 |
1 |
313 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
20344 |
193.4 |
4.1 |
0.294 |
0 |
0 |
0 |
0.000 |
15 |
|
[OLA]A:1215 |
15 |
1 |
496 |
f |
A |
x,-y+2,-z |
4_575 |
23 |
9 |
20344 |
184.6 |
0.3 |
0.140 |
1 |
0 |
0 |
0.000 |
16 |
|
[OLA]A:1224 |
17 |
1 |
574 |
f |
A |
x,y,z |
1_555 |
28 |
7 |
20344 |
184.5 |
-0.2 |
0.238 |
0 |
0 |
0 |
0.000 |
17 |
|
[OLA]A:1226 |
14 |
1 |
500 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
17 |
10 |
20344 |
180.9 |
0.7 |
0.155 |
0 |
0 |
0 |
0.000 |
18 |
|
[OLB]A:1210 |
16 |
1 |
508 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
21 |
4 |
20344 |
162.8 |
2.5 |
0.302 |
0 |
0 |
0 |
0.000 |
19 |
|
[OLB]A:1206 |
16 |
1 |
526 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
20344 |
158.4 |
-0.2 |
0.247 |
1 |
0 |
0 |
0.000 |
20 |
|
[OLC]A:1220 |
13 |
1 |
426 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
20344 |
153.1 |
-0.5 |
0.242 |
2 |
0 |
0 |
0.000 |
21 |
|
[OLB]A:1210 |
12 |
1 |
508 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
20344 |
139.3 |
-1.6 |
0.078 |
2 |
0 |
0 |
0.000 |
22 |
|
[OLA]A:1223 |
13 |
1 |
414 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
20344 |
137.0 |
1.4 |
0.057 |
0 |
0 |
0 |
0.000 |
23 |
|
[OLC]A:1207 |
14 |
1 |
513 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
20344 |
136.3 |
0.4 |
0.232 |
1 |
0 |
0 |
0.000 |
24 |
|
[OLA]A:1215 |
15 |
1 |
496 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
20344 |
134.3 |
0.0 |
0.060 |
0 |
0 |
0 |
0.000 |
25 |
|
[OLC]A:1207 |
15 |
1 |
513 |
f |
[CLR]A:1205 |
x-1,y,z |
1_455 |
17 |
1 |
622 |
117.5 |
3.7 |
0.166 |
0 |
0 |
0 |
0.000 |
26 |
|
[CLR]A:1203 |
20 |
1 |
619 |
◊ |
[CLR]A:1205 |
x-1,y,z |
1_455 |
15 |
1 |
622 |
117.5 |
1.9 |
0.181 |
0 |
0 |
0 |
0.000 |
27 |
|
[OLA]A:1218 |
9 |
1 |
311 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
20344 |
116.6 |
2.5 |
0.754 |
0 |
0 |
0 |
0.000 |
28 |
|
[OLA]A:1226 |
12 |
1 |
500 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
20344 |
114.8 |
-1.9 |
0.066 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
17 |
5 |
20344 |
◊ |
[OLA]A:1224 |
x-1,y,z |
1_455 |
7 |
1 |
574 |
114.6 |
2.1 |
0.648 |
0 |
0 |
0 |
0.000 |
30 |
|
[PEG]A:1225 |
7 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
20344 |
112.7 |
1.8 |
0.261 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
10 |
6 |
20344 |
◊ |
[OLA]A:1219 |
x-1,y,z |
1_455 |
11 |
1 |
391 |
106.1 |
1.8 |
0.407 |
0 |
0 |
0 |
0.000 |
32 |
|
[OLC]A:1221 |
13 |
1 |
504 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
20344 |
104.9 |
0.1 |
0.077 |
0 |
0 |
0 |
0.000 |
33 |
|
[OLC]A:1221 |
13 |
1 |
504 |
◊ |
[CLR]A:1204 |
x,y,z |
1_555 |
14 |
1 |
623 |
103.9 |
4.2 |
0.228 |
0 |
0 |
0 |
0.000 |
34 |
|
[OLC]A:1209 |
10 |
1 |
482 |
f |
[OLC]A:1208 |
x,y,z |
1_555 |
10 |
1 |
513 |
98.8 |
4.7 |
0.234 |
0 |
0 |
0 |
0.000 |
35 |
|
[OLC]A:1221 |
15 |
1 |
504 |
f |
[OLB]A:1206 |
x-1,y,z |
1_455 |
10 |
1 |
526 |
96.1 |
3.1 |
0.154 |
0 |
0 |
0 |
0.000 |
36 |
|
[OLA]A:1227 |
9 |
1 |
606 |
f |
[OLB]A:1210 |
x,y,z |
1_555 |
12 |
1 |
508 |
95.3 |
3.0 |
0.200 |
1 |
0 |
0 |
0.000 |
37 |
|
[OLA]A:1217 |
11 |
1 |
370 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
20344 |
95.1 |
1.3 |
0.332 |
0 |
0 |
0 |
0.000 |
38 |
|
[OLA]A:1213 |
6 |
1 |
371 |
◊ |
A |
x,-y+2,-z |
4_575 |
13 |
4 |
20344 |
93.5 |
2.5 |
0.129 |
0 |
0 |
0 |
0.000 |
39 |
|
[OLB]A:1206 |
10 |
1 |
526 |
f |
[CLR]A:1205 |
x,y,z |
1_555 |
9 |
1 |
622 |
91.9 |
2.0 |
0.280 |
0 |
0 |
0 |
0.000 |
40 |
|
[OLC]A:1207 |
10 |
1 |
513 |
◊ |
[CLR]A:1203 |
x,y,z |
1_555 |
11 |
1 |
619 |
89.4 |
4.4 |
0.326 |
0 |
0 |
0 |
0.000 |
41 |
|
[OLA]A:1214 |
9 |
1 |
392 |
f |
A |
x,y,z |
1_555 |
13 |
2 |
20344 |
87.4 |
1.8 |
0.673 |
0 |
0 |
0 |
0.000 |
42 |
|
[OLC]A:1222 |
8 |
1 |
347 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
20344 |
86.3 |
-3.2 |
0.243 |
1 |
0 |
0 |
0.000 |
43 |
|
[OLA]A:1224 |
10 |
1 |
574 |
f |
[OLC]A:1208 |
x,y,z |
1_555 |
9 |
1 |
513 |
83.1 |
2.2 |
0.147 |
0 |
0 |
0 |
0.000 |
44 |
|
[OLA]A:1217 |
8 |
1 |
370 |
f |
[OLC]A:1220 |
x,y,z |
1_555 |
10 |
1 |
426 |
81.9 |
4.4 |
0.541 |
0 |
0 |
0 |
0.000 |
45 |
|
[OLA]A:1215 |
9 |
1 |
496 |
◊ |
[OLC]A:1212 |
x,y,z |
1_555 |
11 |
1 |
526 |
81.8 |
3.6 |
0.169 |
0 |
0 |
0 |
0.000 |
46 |
|
[CLR]A:1204 |
12 |
1 |
623 |
◊ |
[OLA]A:1219 |
x-1,y,z |
1_455 |
8 |
1 |
391 |
78.6 |
3.5 |
0.517 |
0 |
0 |
0 |
0.000 |
47 |
|
[CLR]A:1203 |
7 |
1 |
619 |
◊ |
[OLB]A:1206 |
x-1,y,z |
1_455 |
12 |
1 |
526 |
77.4 |
3.1 |
0.347 |
0 |
0 |
0 |
0.000 |
48 |
|
[NA]A:1202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
11 |
20344 |
75.4 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.000 |
49 |
|
[OLC]A:1220 |
8 |
1 |
426 |
f |
[OLB]A:1206 |
x,y,z |
1_555 |
12 |
1 |
526 |
74.3 |
3.8 |
0.291 |
0 |
0 |
0 |
0.000 |
50 |
|
[OLC]A:1221 |
8 |
1 |
504 |
◊ |
[CLR]A:1203 |
x,y,z |
1_555 |
9 |
1 |
619 |
74.0 |
2.8 |
0.268 |
0 |
0 |
0 |
0.000 |
51 |
|
[OLC]A:1222 |
9 |
1 |
347 |
f |
[CLR]A:1205 |
x,y,z |
1_555 |
7 |
1 |
622 |
70.6 |
1.4 |
0.325 |
0 |
0 |
0 |
0.000 |
52 |
|
[OLA]A:1217 |
8 |
1 |
370 |
f |
[OLC]A:1211 |
x,y,z |
1_555 |
7 |
1 |
346 |
69.5 |
2.6 |
0.583 |
1 |
0 |
0 |
0.000 |
53 |
|
[OLA]A:1215 |
8 |
1 |
496 |
◊ |
[OLA]A:1214 |
x,y,z |
1_555 |
8 |
1 |
392 |
67.5 |
3.8 |
0.397 |
0 |
0 |
0 |
0.000 |
54 |
|
[OLC]A:1221 |
10 |
1 |
504 |
f |
[OLC]A:1211 |
x-1,y,z |
1_455 |
8 |
1 |
346 |
61.4 |
2.4 |
0.243 |
0 |
0 |
0 |
0.000 |
55 |
|
[CLR]A:1204 |
5 |
1 |
623 |
◊ |
[OLC]A:1211 |
x-1,y,z |
1_455 |
8 |
1 |
346 |
60.1 |
2.1 |
0.414 |
0 |
0 |
0 |
0.000 |
56 |
|
[OLA]A:1218 |
6 |
1 |
311 |
◊ |
A |
x,-y+2,-z |
4_575 |
6 |
4 |
20344 |
59.5 |
1.0 |
0.483 |
0 |
0 |
0 |
0.000 |
57 |
|
[OLC]A:1221 |
8 |
1 |
504 |
f |
[OLC]A:1220 |
x-1,y,z |
1_455 |
7 |
1 |
426 |
58.5 |
2.3 |
0.227 |
0 |
0 |
0 |
0.000 |
58 |
|
[OLC]A:1207 |
7 |
1 |
513 |
f |
[OLC]A:1222 |
x-1,y,z |
1_455 |
9 |
1 |
347 |
56.6 |
3.4 |
0.316 |
0 |
0 |
0 |
0.000 |
59 |
|
[OLC]A:1220 |
8 |
1 |
426 |
f |
[OLC]A:1211 |
x,y,z |
1_555 |
4 |
1 |
346 |
43.6 |
1.4 |
0.314 |
0 |
0 |
0 |
0.000 |
60 |
|
A |
6 |
3 |
20344 |
◊ |
[OLB]A:1206 |
x-1,y,z |
1_455 |
4 |
1 |
526 |
40.4 |
-0.5 |
0.198 |
0 |
0 |
0 |
0.000 |
61 |
|
[OLA]A:1214 |
4 |
1 |
392 |
◊ |
[OLC]A:1212 |
x,y,z |
1_555 |
6 |
1 |
526 |
38.6 |
2.6 |
0.591 |
0 |
0 |
0 |
0.000 |
62 |
|
[OLA]A:1218 |
4 |
1 |
311 |
◊ |
[OLA]A:1217 |
x,y,z |
1_555 |
6 |
1 |
370 |
38.3 |
2.3 |
1.000 |
0 |
0 |
0 |
0.000 |
63 |
|
[PEG]A:1225 |
5 |
1 |
261 |
f |
[OLA]A:1226 |
x,y,z |
1_555 |
6 |
1 |
500 |
32.2 |
1.9 |
0.145 |
0 |
0 |
0 |
0.000 |
64 |
|
[OLA]A:1214 |
3 |
1 |
392 |
◊ |
A |
x,-y+2,-z |
4_575 |
7 |
1 |
20344 |
30.0 |
0.6 |
0.789 |
0 |
0 |
0 |
0.000 |
65 |
|
[OLA]A:1227 |
3 |
1 |
606 |
f |
[OLC]A:1222 |
x,y,z |
1_555 |
7 |
1 |
347 |
29.2 |
0.1 |
0.307 |
1 |
0 |
0 |
0.000 |
66 |
|
[OLA]A:1226 |
4 |
1 |
500 |
f |
[OLB]A:1210 |
x,y,z |
1_555 |
3 |
1 |
508 |
25.9 |
0.7 |
0.199 |
0 |
0 |
0 |
0.000 |
67 |
|
[OLA]A:1227 |
2 |
1 |
606 |
f |
[OLC]A:1209 |
x,y,z |
1_555 |
3 |
1 |
482 |
24.2 |
0.3 |
0.242 |
0 |
0 |
0 |
0.000 |
68 |
|
[OLA]A:1219 |
6 |
1 |
391 |
f |
[OLC]A:1211 |
x,y,z |
1_555 |
3 |
1 |
346 |
24.0 |
0.0 |
0.514 |
0 |
0 |
0 |
0.000 |
69 |
|
[OLA]A:1226 |
2 |
1 |
500 |
◊ |
[OLA]A:1216 |
-x+1,y,-z+1/2 |
3_655 |
2 |
1 |
313 |
11.8 |
0.8 |
0.579 |
0 |
0 |
0 |
0.000 |
70 |
|
[OLC]A:1212 |
2 |
1 |
526 |
f |
[OLC]A:1212 |
x,-y+2,-z |
4_575 |
2 |
1 |
526 |
9.8 |
0.1 |
0.306 |
0 |
0 |
0 |
0.000 |
71 |
|
[OLC]A:1207 |
2 |
1 |
513 |
f |
A |
x-1,y,z |
1_455 |
1 |
1 |
20344 |
7.8 |
-0.5 |
0.253 |
0 |
0 |
0 |
0.000 |
72 |
|
A |
1 |
1 |
20344 |
◊ |
[OLC]A:1208 |
x-1,y,z |
1_455 |
1 |
1 |
513 |
6.6 |
0.1 |
0.312 |
0 |
0 |
0 |
0.000 |
73 |
|
[OLA]A:1218 |
2 |
1 |
311 |
f |
[OLA]A:1213 |
x,-y+2,-z |
4_575 |
2 |
1 |
371 |
5.5 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
74 |
|
[OLA]A:1215 |
1 |
1 |
496 |
◊ |
[OLC]A:1212 |
x,-y+2,-z |
4_575 |
1 |
1 |
526 |
5.1 |
-0.2 |
0.236 |
0 |
0 |
0 |
0.000 |
75 |
|
[OLC]A:1221 |
1 |
1 |
504 |
f |
[CLR]A:1205 |
x-1,y,z |
1_455 |
1 |
1 |
622 |
4.2 |
0.1 |
0.330 |
0 |
0 |
0 |
0.000 |
76 |
|
[OLA]A:1223 |
1 |
1 |
414 |
f |
[CLR]A:1204 |
x,y,z |
1_555 |
1 |
1 |
623 |
1.2 |
0.0 |
0.196 |
0 |
0 |
0 |
0.000 |
77 |
|
[OLC]A:1208 |
1 |
1 |
513 |
f |
[CLR]A:1205 |
x,y,z |
1_555 |
1 |
1 |
622 |
0.3 |
0.0 |
0.297 |
0 |
0 |
0 |
0.000 |
|