## |
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 |
|
G |
127 |
31 |
6547 |
◊ |
F |
x,y,z |
1_555 |
120 |
33 |
6287 |
1213.1 |
-10.1 |
0.226 |
22 |
4 |
0 |
0.951 |
2 |
|
K |
107 |
29 |
5804 |
◊ |
J |
x,y,z |
1_555 |
114 |
33 |
6080 |
1088.8 |
-7.7 |
0.396 |
22 |
4 |
0 |
0.951 |
3 |
|
M |
111 |
32 |
5958 |
◊ |
I |
x,y,z |
1_555 |
106 |
25 |
5977 |
1060.8 |
-10.2 |
0.248 |
17 |
4 |
0 |
0.951 |
4 |
|
M |
100 |
28 |
5958 |
◊ |
L |
x,y,z |
1_555 |
106 |
31 |
5813 |
1051.5 |
-10.1 |
0.175 |
18 |
2 |
0 |
0.951 |
5 |
|
J |
100 |
24 |
6080 |
◊ |
I |
x,y,z |
1_555 |
112 |
29 |
5977 |
1049.1 |
-9.8 |
0.279 |
16 |
4 |
0 |
0.951 |
6 |
|
H |
102 |
25 |
6084 |
◊ |
G |
x,y,z |
1_555 |
107 |
31 |
6547 |
1040.4 |
-8.5 |
0.225 |
17 |
4 |
0 |
0.951 |
7 |
|
H |
108 |
29 |
6084 |
◊ |
D |
x,y,z |
1_555 |
108 |
28 |
5575 |
1033.3 |
-9.9 |
0.197 |
20 |
4 |
0 |
0.951 |
8 |
|
F |
94 |
24 |
6287 |
◊ |
E |
x,y,z |
1_555 |
109 |
28 |
5713 |
1012.1 |
-10.8 |
0.152 |
14 |
6 |
0 |
0.951 |
9 |
|
L |
94 |
25 |
5813 |
◊ |
K |
x,y,z |
1_555 |
101 |
30 |
5804 |
973.1 |
-10.0 |
0.206 |
16 |
2 |
0 |
0.951 |
10 |
|
E |
92 |
21 |
5713 |
◊ |
D |
x,y,z |
1_555 |
95 |
29 |
5575 |
937.0 |
-7.7 |
0.310 |
13 |
4 |
0 |
0.951 |
Average: |
1045.9 |
-9.5 |
0.241 |
18 |
4 |
0 |
0.951 |
2 |
11 |
|
J |
59 |
17 |
6080 |
◊ |
F |
x-1/2,y-1/2,z |
3_445 |
58 |
16 |
6287 |
513.5 |
0.0 |
0.667 |
9 |
0 |
0 |
0.000 |
3 |
12 |
|
G |
47 |
13 |
6547 |
◊ |
G |
-x+1,y,-z |
2_655 |
47 |
13 |
6547 |
464.0 |
-5.4 |
0.233 |
2 |
0 |
0 |
0.000 |
4 |
13 |
|
L |
39 |
15 |
5813 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
34 |
15 |
6084 |
308.9 |
-2.4 |
0.369 |
2 |
0 |
0 |
0.000 |
5 |
14 |
|
J |
30 |
8 |
6080 |
◊ |
D |
x,y,z |
1_555 |
36 |
13 |
5575 |
277.9 |
-0.1 |
0.640 |
5 |
3 |
0 |
0.000 |
6 |
15 |
|
M |
30 |
7 |
5958 |
◊ |
G |
-x+1,y,-z+1 |
2_656 |
29 |
9 |
6547 |
246.5 |
0.5 |
0.709 |
5 |
0 |
0 |
0.000 |
7 |
16 |
|
H |
33 |
8 |
6084 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
23 |
6 |
5713 |
231.0 |
-2.4 |
0.374 |
1 |
2 |
0 |
0.000 |
17 |
|
I |
21 |
6 |
5977 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
29 |
8 |
5813 |
212.9 |
-3.1 |
0.281 |
0 |
0 |
0 |
0.000 |
Average: |
221.9 |
-2.8 |
0.327 |
1 |
1 |
0 |
0.000 |
8 |
18 |
|
K |
25 |
9 |
5804 |
◊ |
D |
-x,y,-z |
2_555 |
29 |
7 |
5575 |
222.7 |
1.3 |
0.822 |
4 |
0 |
0 |
0.000 |
9 |
19 |
|
F |
18 |
4 |
6287 |
◊ |
M |
x,y,z-1 |
1_554 |
26 |
8 |
5958 |
215.3 |
-0.1 |
0.537 |
4 |
1 |
0 |
0.000 |
10 |
20 |
|
K |
21 |
7 |
5804 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
29 |
7 |
6084 |
198.9 |
-0.1 |
0.645 |
6 |
0 |
0 |
0.000 |
21 |
|
L |
23 |
7 |
5813 |
◊ |
G |
x-1/2,y+1/2,z |
3_455 |
18 |
6 |
6547 |
187.0 |
-0.4 |
0.550 |
5 |
0 |
0 |
0.000 |
Average: |
192.9 |
-0.2 |
0.597 |
6 |
0 |
0 |
0.000 |
11 |
22 |
|
I |
18 |
5 |
5977 |
◊ |
G |
-x+1,y,-z+1 |
2_656 |
25 |
10 |
6547 |
161.8 |
-1.9 |
0.387 |
0 |
0 |
0 |
0.000 |
23 |
|
K |
8 |
4 |
5804 |
◊ |
E |
-x,y,-z |
2_555 |
6 |
3 |
5713 |
43.5 |
0.8 |
0.694 |
0 |
0 |
0 |
0.000 |
Average: |
102.7 |
-0.6 |
0.541 |
0 |
0 |
0 |
0.000 |
12 |
24 |
|
G |
17 |
5 |
6547 |
◊ |
M |
x,y,z-1 |
1_554 |
15 |
7 |
5958 |
156.4 |
-0.1 |
0.548 |
0 |
0 |
0 |
0.000 |
13 |
25 |
|
H |
15 |
5 |
6084 |
◊ |
M |
-x+1/2,y-1/2,-z+1 |
4_546 |
15 |
5 |
5958 |
120.7 |
-1.7 |
0.323 |
1 |
0 |
0 |
0.000 |
14 |
26 |
|
K |
13 |
2 |
5804 |
◊ |
D |
x,y,z |
1_555 |
13 |
6 |
5575 |
117.2 |
-1.7 |
0.330 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
[GOL]E:1104 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
20 |
8 |
5713 |
116.9 |
0.1 |
0.617 |
7 |
0 |
0 |
0.100 |
16 |
28 |
|
[GOL]I:1103 |
6 |
1 |
214 |
f |
I |
x,y,z |
1_555 |
18 |
8 |
5977 |
116.6 |
-0.2 |
0.623 |
4 |
0 |
0 |
0.059 |
17 |
29 |
|
D |
13 |
4 |
5575 |
◊ |
E |
-x+1/2,y-1/2,-z |
4_545 |
17 |
5 |
5713 |
114.0 |
-1.3 |
0.435 |
1 |
0 |
0 |
0.000 |
30 |
|
I |
9 |
2 |
5977 |
◊ |
M |
-x+1/2,y-1/2,-z+1 |
4_546 |
11 |
4 |
5958 |
93.1 |
-0.0 |
0.579 |
2 |
2 |
0 |
0.000 |
Average: |
103.5 |
-0.7 |
0.507 |
2 |
1 |
0 |
0.000 |
18 |
31 |
|
L |
12 |
5 |
5813 |
◊ |
L |
-x,y,-z+1 |
2_556 |
12 |
5 |
5813 |
102.7 |
0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
[EDO]J:1103 |
4 |
1 |
184 |
◊ |
J |
x,y,z |
1_555 |
18 |
8 |
6080 |
98.4 |
2.5 |
0.463 |
4 |
0 |
0 |
0.000 |
20 |
33 |
|
[GOL]E:1103 |
6 |
1 |
221 |
◊ |
E |
x,y,z |
1_555 |
17 |
5 |
5713 |
95.8 |
-0.8 |
0.492 |
0 |
0 |
0 |
0.008 |
21 |
34 |
|
[GOL]K:1103 |
6 |
1 |
216 |
f |
K |
x,y,z |
1_555 |
17 |
5 |
5804 |
92.0 |
-0.9 |
0.503 |
0 |
0 |
0 |
0.168 |
22 |
35 |
|
M |
7 |
2 |
5958 |
◊ |
F |
-x+1,y,-z+1 |
2_656 |
12 |
5 |
6287 |
91.7 |
-0.2 |
0.382 |
2 |
2 |
0 |
0.000 |
36 |
|
J |
14 |
4 |
6080 |
◊ |
D |
-x,y,-z |
2_555 |
8 |
2 |
5575 |
88.8 |
0.1 |
0.601 |
1 |
2 |
0 |
0.000 |
Average: |
90.3 |
-0.0 |
0.491 |
2 |
2 |
0 |
0.000 |
23 |
37 |
|
[GOL]I:1104 |
6 |
1 |
216 |
◊ |
J |
x,y,z |
1_555 |
17 |
5 |
6080 |
89.6 |
-1.1 |
0.458 |
0 |
0 |
0 |
0.012 |
24 |
38 |
|
[GOL]M:1104 |
6 |
1 |
218 |
◊ |
M |
x,y,z |
1_555 |
16 |
4 |
5958 |
89.5 |
-0.6 |
0.483 |
0 |
0 |
0 |
0.006 |
25 |
39 |
|
[GOL]G:1104 |
6 |
1 |
216 |
f |
G |
x,y,z |
1_555 |
17 |
5 |
6547 |
89.3 |
-1.3 |
0.413 |
0 |
0 |
0 |
0.100 |
26 |
40 |
|
[GOL]L:1104 |
5 |
1 |
217 |
f |
L |
x,y,z |
1_555 |
16 |
4 |
5813 |
88.0 |
-1.3 |
0.385 |
0 |
0 |
0 |
0.051 |
27 |
41 |
|
[EDO]D:1104 |
4 |
1 |
183 |
◊ |
D |
x,y,z |
1_555 |
14 |
6 |
5575 |
87.6 |
2.2 |
0.274 |
4 |
0 |
0 |
0.000 |
28 |
42 |
|
H |
14 |
6 |
6084 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
11 |
6 |
5813 |
85.3 |
1.8 |
0.810 |
2 |
2 |
0 |
0.000 |
29 |
43 |
|
I |
11 |
4 |
5977 |
◊ |
E |
-x+1/2,y-1/2,-z+1 |
4_546 |
8 |
3 |
5713 |
77.1 |
1.0 |
0.775 |
1 |
0 |
0 |
0.000 |
30 |
44 |
|
[EDO]L:1103 |
4 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
14 |
5 |
5813 |
73.0 |
1.8 |
0.776 |
1 |
0 |
0 |
0.000 |
31 |
45 |
|
[EDO]H:1104 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
15 |
4 |
5575 |
72.1 |
1.3 |
0.221 |
0 |
0 |
0 |
0.000 |
32 |
46 |
|
D |
7 |
3 |
5575 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
8 |
2 |
6287 |
53.6 |
0.7 |
0.746 |
1 |
0 |
0 |
0.000 |
33 |
47 |
|
[GOL]I:1104 |
4 |
1 |
216 |
f |
I |
x,y,z |
1_555 |
6 |
4 |
5977 |
47.0 |
-1.4 |
0.297 |
0 |
0 |
0 |
0.041 |
34 |
48 |
|
[GOL]G:1104 |
4 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
4 |
4 |
6287 |
46.3 |
-0.8 |
0.294 |
0 |
0 |
0 |
0.009 |
35 |
49 |
|
[GOL]L:1104 |
5 |
1 |
217 |
◊ |
K |
x,y,z |
1_555 |
3 |
3 |
5804 |
44.9 |
-0.9 |
0.221 |
0 |
0 |
0 |
0.009 |
36 |
50 |
|
[GOL]M:1104 |
5 |
1 |
218 |
f |
L |
x,y,z |
1_555 |
2 |
2 |
5813 |
44.8 |
-1.1 |
0.144 |
0 |
0 |
0 |
0.046 |
37 |
51 |
|
[GOL]E:1103 |
3 |
1 |
221 |
f |
D |
x,y,z |
1_555 |
6 |
4 |
5575 |
42.1 |
-1.1 |
0.253 |
0 |
0 |
0 |
0.100 |
38 |
52 |
|
J |
4 |
2 |
6080 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
2 |
5813 |
41.3 |
-1.1 |
0.208 |
0 |
0 |
0 |
0.000 |
39 |
53 |
|
[EDO]H:1104 |
4 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
2 |
2 |
6084 |
41.1 |
0.4 |
0.272 |
0 |
0 |
0 |
0.000 |
40 |
54 |
|
H |
4 |
2 |
6084 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
5 |
2 |
6287 |
40.1 |
-0.3 |
0.438 |
1 |
0 |
0 |
0.000 |
41 |
55 |
|
[GOL]K:1103 |
5 |
1 |
216 |
◊ |
J |
x,y,z |
1_555 |
5 |
4 |
6080 |
39.5 |
-0.9 |
0.293 |
0 |
0 |
0 |
0.009 |
42 |
56 |
|
H |
3 |
1 |
6084 |
◊ |
G |
-x+1,y,-z |
2_655 |
4 |
2 |
6547 |
37.7 |
0.3 |
0.721 |
1 |
0 |
0 |
0.000 |
43 |
57 |
|
K |
5 |
1 |
5804 |
◊ |
K |
-x,y,-z |
2_555 |
5 |
1 |
5804 |
35.3 |
0.3 |
0.726 |
0 |
0 |
0 |
0.000 |
44 |
58 |
|
[EDO]L:1103 |
3 |
1 |
186 |
f |
K |
x,y,z |
1_555 |
2 |
1 |
5804 |
34.8 |
0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
45 |
59 |
|
[GOL]L:1104 |
4 |
1 |
217 |
◊ |
[GOL]K:1103 |
x,y,z |
1_555 |
3 |
1 |
216 |
30.6 |
0.1 |
0.614 |
0 |
0 |
0 |
0.000 |
46 |
60 |
|
[GOL]M:1104 |
3 |
1 |
218 |
f |
[GOL]L:1104 |
x,y,z |
1_555 |
4 |
1 |
217 |
28.6 |
-0.1 |
0.544 |
0 |
0 |
0 |
0.003 |
47 |
61 |
|
[GOL]K:1103 |
3 |
1 |
216 |
◊ |
[GOL]I:1104 |
x,y,z |
1_555 |
2 |
1 |
216 |
22.6 |
0.2 |
0.595 |
0 |
0 |
0 |
0.000 |
48 |
62 |
|
[EDO]D:1104 |
1 |
1 |
183 |
f |
J |
x,y,z |
1_555 |
3 |
1 |
6080 |
17.7 |
0.4 |
0.405 |
0 |
0 |
0 |
0.000 |
49 |
63 |
|
L |
1 |
1 |
5813 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
5713 |
16.5 |
0.6 |
0.785 |
0 |
0 |
0 |
0.000 |
50 |
64 |
|
[GOL]E:1103 |
3 |
1 |
221 |
◊ |
[EDO]H:1104 |
x,y,z |
1_555 |
2 |
1 |
184 |
16.5 |
0.4 |
0.677 |
0 |
0 |
0 |
0.000 |
51 |
65 |
|
[EDO]D:1104 |
2 |
1 |
183 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
6084 |
14.5 |
0.6 |
0.874 |
0 |
0 |
0 |
0.000 |
52 |
66 |
|
[EDO]J:1103 |
1 |
1 |
184 |
f |
F |
x-1/2,y-1/2,z |
3_445 |
3 |
1 |
6287 |
11.1 |
0.4 |
0.806 |
0 |
0 |
0 |
0.000 |
53 |
67 |
|
[GOL]I:1103 |
2 |
1 |
214 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
5958 |
10.7 |
0.2 |
0.704 |
0 |
0 |
0 |
0.000 |
54 |
68 |
|
K |
3 |
2 |
5804 |
◊ |
G |
x-1/2,y+1/2,z |
3_455 |
2 |
2 |
6547 |
9.8 |
0.1 |
0.624 |
0 |
0 |
0 |
0.000 |
55 |
69 |
|
[GOL]E:1104 |
2 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
5575 |
6.0 |
0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
56 |
70 |
|
D |
1 |
1 |
5575 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
5813 |
4.7 |
-0.1 |
0.467 |
0 |
0 |
0 |
0.000 |
57 |
71 |
|
M |
1 |
1 |
5958 |
◊ |
K |
-x,y,-z+1 |
2_556 |
1 |
1 |
5804 |
0.1 |
-0.0 |
0.635 |
0 |
0 |
0 |
0.000 |
|