## |
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 |
111 |
29 |
8883 |
◊ |
B |
x,y,z |
1_555 |
113 |
29 |
8708 |
1083.4 |
-13.7 |
0.154 |
14 |
8 |
0 |
0.914 |
2 |
|
F |
114 |
29 |
8688 |
◊ |
E |
x,y,z |
1_555 |
112 |
29 |
8671 |
1067.3 |
-13.5 |
0.172 |
12 |
9 |
0 |
0.914 |
3 |
|
C |
111 |
28 |
8669 |
◊ |
A |
x,y,z |
1_555 |
108 |
27 |
8680 |
1031.7 |
-13.5 |
0.155 |
12 |
8 |
0 |
0.914 |
Average: |
1060.8 |
-13.6 |
0.160 |
13 |
8 |
0 |
0.914 |
2 |
4 |
|
F |
72 |
21 |
8688 |
◊ |
C |
x,y,z |
1_555 |
59 |
16 |
8669 |
616.6 |
-9.8 |
0.113 |
4 |
1 |
0 |
0.680 |
5 |
|
D |
62 |
20 |
8883 |
◊ |
A |
x,y,z |
1_555 |
53 |
15 |
8680 |
611.6 |
-8.6 |
0.146 |
4 |
1 |
0 |
0.680 |
6 |
|
E |
68 |
20 |
8671 |
◊ |
D |
x,y,z |
1_555 |
58 |
15 |
8883 |
610.7 |
-10.2 |
0.109 |
4 |
1 |
0 |
0.680 |
7 |
|
C |
65 |
22 |
8669 |
◊ |
B |
x,y,z |
1_555 |
53 |
15 |
8708 |
594.8 |
-7.5 |
0.173 |
5 |
1 |
0 |
0.680 |
8 |
|
E |
53 |
16 |
8671 |
◊ |
A |
x,y,z |
1_555 |
65 |
19 |
8680 |
563.4 |
-10.3 |
0.062 |
1 |
0 |
0 |
0.680 |
9 |
|
F |
53 |
16 |
8688 |
◊ |
B |
x,y,z |
1_555 |
62 |
19 |
8708 |
542.6 |
-9.8 |
0.067 |
2 |
0 |
0 |
0.680 |
Average: |
589.9 |
-9.4 |
0.111 |
3 |
1 |
0 |
0.680 |
3 |
10 |
|
[ANP]B:1001 |
30 |
1 |
604 |
f |
B |
x,y,z |
1_555 |
58 |
24 |
8708 |
423.7 |
-0.2 |
0.706 |
17 |
0 |
0 |
1.000 |
11 |
|
[ANP]A:1001 |
29 |
1 |
600 |
f |
A |
x,y,z |
1_555 |
56 |
23 |
8680 |
422.5 |
0.1 |
0.717 |
18 |
0 |
0 |
1.000 |
12 |
|
[ANP]C:1001 |
29 |
1 |
603 |
f |
C |
x,y,z |
1_555 |
56 |
24 |
8669 |
420.1 |
0.3 |
0.734 |
17 |
0 |
0 |
1.000 |
13 |
|
[ANP]F:1001 |
29 |
1 |
598 |
f |
F |
x,y,z |
1_555 |
57 |
24 |
8688 |
414.6 |
0.4 |
0.734 |
14 |
0 |
0 |
1.000 |
14 |
|
[ANP]D:1001 |
28 |
1 |
599 |
f |
D |
x,y,z |
1_555 |
59 |
25 |
8883 |
413.3 |
0.9 |
0.729 |
14 |
0 |
0 |
1.000 |
15 |
|
[ANP]E:1001 |
29 |
1 |
599 |
f |
E |
x,y,z |
1_555 |
55 |
24 |
8671 |
412.1 |
0.5 |
0.729 |
17 |
0 |
0 |
1.000 |
Average: |
417.7 |
0.3 |
0.725 |
16 |
0 |
0 |
1.000 |
4 |
16 |
|
B |
39 |
13 |
8708 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
32 |
14 |
8669 |
309.2 |
2.2 |
0.872 |
6 |
1 |
0 |
0.000 |
17 |
|
D |
31 |
14 |
8883 |
◊ |
A |
-x-1,y-1/2,-z-1 |
2_444 |
35 |
11 |
8680 |
309.0 |
1.3 |
0.824 |
5 |
2 |
0 |
0.000 |
Average: |
309.1 |
1.8 |
0.848 |
6 |
2 |
0 |
0.000 |
5 |
18 |
|
F |
21 |
7 |
8688 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
23 |
8 |
8680 |
225.7 |
1.6 |
0.848 |
4 |
5 |
0 |
0.000 |
19 |
|
B |
22 |
8 |
8708 |
◊ |
E |
-x-1,y-1/2,-z |
2_445 |
24 |
6 |
8671 |
218.2 |
1.4 |
0.822 |
5 |
5 |
0 |
0.000 |
Average: |
221.9 |
1.5 |
0.835 |
5 |
5 |
0 |
0.000 |
6 |
20 |
|
E |
17 |
5 |
8671 |
◊ |
B |
x,y,z |
1_555 |
18 |
6 |
8708 |
136.1 |
-2.5 |
0.276 |
0 |
0 |
0 |
0.047 |
21 |
|
F |
15 |
5 |
8688 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
8680 |
133.7 |
-3.1 |
0.167 |
0 |
0 |
0 |
0.047 |
22 |
|
D |
15 |
5 |
8883 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
8669 |
109.0 |
-2.0 |
0.332 |
0 |
0 |
0 |
0.047 |
Average: |
126.3 |
-2.5 |
0.258 |
0 |
0 |
0 |
0.047 |
7 |
23 |
|
[DMS]E:1006 |
4 |
1 |
209 |
f |
E |
x,y,z |
1_555 |
22 |
11 |
8671 |
130.6 |
3.2 |
0.567 |
0 |
0 |
0 |
0.000 |
8 |
24 |
|
[GOL]C:1004 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
24 |
12 |
8669 |
128.9 |
-0.3 |
0.554 |
2 |
0 |
0 |
0.036 |
9 |
25 |
|
[DMS]C:1002 |
4 |
1 |
210 |
f |
C |
x,y,z |
1_555 |
26 |
8 |
8669 |
127.0 |
3.9 |
0.628 |
0 |
0 |
0 |
0.000 |
10 |
26 |
|
[DMS]D:1002 |
4 |
1 |
208 |
f |
D |
x,y,z |
1_555 |
22 |
11 |
8883 |
124.5 |
2.2 |
0.514 |
0 |
0 |
0 |
0.000 |
11 |
27 |
|
[DMS]F:1004 |
4 |
1 |
209 |
f |
F |
x,y,z |
1_555 |
22 |
8 |
8688 |
119.3 |
2.6 |
0.519 |
0 |
0 |
0 |
0.000 |
12 |
28 |
|
[DMS]E:1004 |
4 |
1 |
209 |
f |
E |
x,y,z |
1_555 |
20 |
7 |
8671 |
117.4 |
2.9 |
0.496 |
1 |
0 |
0 |
0.000 |
13 |
29 |
|
[DMS]B:1003 |
4 |
1 |
209 |
f |
B |
x,y,z |
1_555 |
22 |
11 |
8708 |
116.5 |
2.2 |
0.520 |
0 |
0 |
0 |
0.000 |
14 |
30 |
|
[DMS]D:1003 |
4 |
1 |
210 |
f |
D |
x,y,z |
1_555 |
22 |
8 |
8883 |
114.6 |
3.2 |
0.533 |
1 |
0 |
0 |
0.000 |
15 |
31 |
|
[DMS]B:1002 |
4 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
8708 |
107.8 |
3.2 |
0.495 |
1 |
0 |
0 |
0.000 |
16 |
32 |
|
E |
15 |
5 |
8671 |
◊ |
C |
x-1,y,z |
1_455 |
12 |
4 |
8669 |
99.6 |
-0.2 |
0.618 |
0 |
1 |
0 |
0.000 |
33 |
|
D |
9 |
3 |
8883 |
◊ |
F |
x,y,z-1 |
1_554 |
16 |
4 |
8688 |
91.6 |
0.3 |
0.707 |
0 |
2 |
0 |
0.000 |
Average: |
95.6 |
0.0 |
0.662 |
0 |
2 |
0 |
0.000 |
17 |
34 |
|
[DMS]E:1005 |
4 |
1 |
210 |
f |
E |
x,y,z |
1_555 |
14 |
7 |
8671 |
98.9 |
1.5 |
0.405 |
2 |
0 |
0 |
0.000 |
18 |
35 |
|
[DMS]F:1003 |
4 |
1 |
209 |
◊ |
F |
x,y,z |
1_555 |
12 |
8 |
8688 |
97.2 |
1.3 |
0.380 |
1 |
0 |
0 |
0.000 |
19 |
36 |
|
[DMS]F:1002 |
4 |
1 |
210 |
f |
C |
x,y,z |
1_555 |
13 |
8 |
8669 |
93.2 |
0.9 |
0.285 |
0 |
0 |
0 |
0.000 |
20 |
37 |
|
[PO4]A:1004 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
8680 |
93.1 |
-5.3 |
0.841 |
1 |
0 |
0 |
0.155 |
21 |
38 |
|
[DMS]E:1002 |
4 |
1 |
208 |
f |
E |
x,y,z |
1_555 |
12 |
7 |
8671 |
90.7 |
0.5 |
0.262 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
[PO4]C:1003 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
8708 |
88.3 |
-5.5 |
0.478 |
0 |
0 |
0 |
0.163 |
23 |
40 |
|
[DMS]B:1004 |
4 |
1 |
211 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
8708 |
87.0 |
2.9 |
0.531 |
1 |
0 |
0 |
0.000 |
24 |
41 |
|
[DMS]E:1003 |
3 |
1 |
210 |
◊ |
F |
x,y,z |
1_555 |
14 |
6 |
8688 |
78.2 |
1.6 |
0.522 |
0 |
0 |
0 |
0.000 |
25 |
42 |
|
[DMS]A:1002 |
4 |
1 |
209 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
8669 |
76.4 |
1.0 |
0.403 |
0 |
0 |
0 |
0.000 |
26 |
43 |
|
[FMT]B:1005 |
3 |
1 |
149 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
14 |
6 |
8669 |
75.1 |
0.2 |
0.683 |
0 |
0 |
0 |
0.000 |
27 |
44 |
|
[DMS]F:1003 |
4 |
1 |
209 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
8708 |
74.6 |
0.5 |
0.268 |
0 |
0 |
0 |
0.000 |
28 |
45 |
|
[DMS]E:1002 |
4 |
1 |
208 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
8680 |
72.3 |
1.1 |
0.368 |
0 |
0 |
0 |
0.000 |
29 |
46 |
|
[DMS]A:1002 |
4 |
1 |
209 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
8680 |
71.9 |
2.1 |
0.361 |
0 |
0 |
0 |
0.000 |
30 |
47 |
|
[DMS]A:1005 |
4 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8680 |
70.9 |
0.2 |
0.304 |
0 |
0 |
0 |
0.000 |
31 |
48 |
|
[PO4]C:1003 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
8669 |
70.0 |
-4.7 |
0.568 |
0 |
0 |
0 |
0.095 |
32 |
49 |
|
[FMT]B:1008 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
8708 |
69.9 |
-0.6 |
0.375 |
2 |
0 |
0 |
0.045 |
33 |
50 |
|
[FMT]B:1007 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
8708 |
67.5 |
0.0 |
0.419 |
0 |
0 |
0 |
0.000 |
34 |
51 |
|
[DMS]A:1005 |
4 |
1 |
209 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
8669 |
66.9 |
1.4 |
0.385 |
0 |
0 |
0 |
0.000 |
35 |
52 |
|
[DMS]F:1002 |
4 |
1 |
210 |
◊ |
F |
x,y,z |
1_555 |
8 |
4 |
8688 |
66.6 |
0.9 |
0.271 |
0 |
0 |
0 |
0.000 |
36 |
53 |
|
[FMT]A:1003 |
3 |
1 |
148 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
8680 |
63.6 |
-0.1 |
0.430 |
0 |
0 |
0 |
0.000 |
37 |
54 |
|
D |
12 |
4 |
8883 |
f |
[FMT]A:1003 |
-x-1,y-1/2,-z-1 |
2_444 |
3 |
1 |
148 |
62.7 |
0.3 |
0.704 |
2 |
0 |
0 |
0.022 |
38 |
55 |
|
[FMT]B:1006 |
3 |
1 |
148 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
11 |
4 |
8669 |
61.9 |
0.3 |
0.718 |
1 |
0 |
0 |
0.000 |
39 |
56 |
|
[GOL]C:1005 |
5 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
8669 |
61.9 |
0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
40 |
57 |
|
[DMS]E:1003 |
4 |
1 |
210 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
8671 |
61.9 |
-0.7 |
0.219 |
0 |
0 |
0 |
0.235 |
41 |
58 |
|
[FMT]D:1004 |
3 |
1 |
149 |
f |
D |
x,y,z |
1_555 |
12 |
3 |
8883 |
61.8 |
-0.0 |
0.397 |
1 |
0 |
0 |
0.018 |
42 |
59 |
|
[FMT]B:1006 |
3 |
1 |
148 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
8708 |
57.6 |
-0.2 |
0.430 |
0 |
0 |
0 |
0.006 |
43 |
60 |
|
[DMS]B:1004 |
4 |
1 |
211 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
8883 |
54.6 |
-1.0 |
0.225 |
0 |
0 |
0 |
0.036 |
44 |
61 |
|
[PO4]A:1004 |
4 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
8669 |
50.4 |
-2.5 |
0.905 |
2 |
0 |
0 |
0.092 |
45 |
62 |
|
[FMT]B:1005 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
8708 |
41.9 |
0.2 |
0.468 |
0 |
0 |
0 |
0.000 |
46 |
63 |
|
[GOL]C:1005 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
8680 |
35.8 |
0.3 |
0.649 |
0 |
0 |
0 |
0.000 |
47 |
64 |
|
[DMS]B:1003 |
2 |
1 |
209 |
◊ |
[DMS]B:1002 |
x,y,z |
1_555 |
2 |
1 |
209 |
31.8 |
2.1 |
0.750 |
0 |
0 |
0 |
0.000 |
48 |
65 |
|
[GOL]C:1004 |
5 |
1 |
219 |
f |
[DMS]F:1002 |
x,y,z |
1_555 |
3 |
1 |
210 |
22.7 |
0.6 |
0.345 |
0 |
0 |
0 |
0.000 |
49 |
66 |
|
[DMS]E:1006 |
2 |
1 |
209 |
f |
[DMS]E:1002 |
x,y,z |
1_555 |
2 |
1 |
208 |
21.7 |
1.0 |
0.438 |
0 |
0 |
0 |
0.000 |
50 |
67 |
|
[DMS]B:1002 |
2 |
1 |
209 |
f |
C |
x,y,z |
1_555 |
2 |
1 |
8669 |
20.5 |
-1.1 |
0.316 |
0 |
0 |
0 |
0.032 |
51 |
68 |
|
B |
2 |
2 |
8708 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
8680 |
15.0 |
-0.2 |
0.445 |
0 |
0 |
0 |
0.001 |
69 |
|
F |
1 |
1 |
8688 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8883 |
4.7 |
-0.0 |
0.546 |
0 |
0 |
0 |
0.001 |
Average: |
9.9 |
-0.1 |
0.495 |
0 |
0 |
0 |
0.001 |
52 |
70 |
|
[DMS]B:1003 |
1 |
1 |
209 |
f |
[ANP]B:1001 |
x,y,z |
1_555 |
2 |
1 |
604 |
14.7 |
-0.2 |
0.392 |
0 |
0 |
0 |
0.007 |
53 |
71 |
|
[FMT]B:1006 |
2 |
1 |
148 |
f |
[FMT]B:1005 |
x,y,z |
1_555 |
2 |
1 |
149 |
14.4 |
-0.0 |
0.556 |
0 |
0 |
0 |
0.000 |
54 |
72 |
|
[DMS]E:1006 |
1 |
1 |
209 |
f |
[ANP]E:1001 |
x,y,z |
1_555 |
2 |
1 |
599 |
13.1 |
-0.3 |
0.395 |
0 |
0 |
0 |
0.105 |
55 |
73 |
|
[PO4]A:1004 |
1 |
1 |
188 |
f |
[DMS]A:1005 |
x,y,z |
1_555 |
1 |
1 |
209 |
11.5 |
-0.5 |
0.447 |
0 |
0 |
0 |
0.013 |
56 |
74 |
|
[PO4]C:1003 |
3 |
1 |
187 |
f |
[DMS]B:1003 |
x,y,z |
1_555 |
2 |
1 |
209 |
10.3 |
-0.1 |
0.659 |
0 |
0 |
0 |
0.004 |
57 |
75 |
|
[GOL]C:1004 |
1 |
1 |
219 |
f |
[ANP]C:1001 |
x,y,z |
1_555 |
1 |
1 |
603 |
5.4 |
-0.4 |
0.365 |
0 |
0 |
0 |
0.011 |
58 |
76 |
|
[GOL]C:1004 |
1 |
1 |
219 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
8688 |
3.3 |
-0.0 |
0.460 |
0 |
0 |
0 |
0.000 |
59 |
77 |
|
[DMS]D:1002 |
1 |
1 |
208 |
f |
[ANP]D:1001 |
x,y,z |
1_555 |
1 |
1 |
599 |
2.9 |
-0.1 |
0.267 |
0 |
0 |
0 |
0.005 |
60 |
78 |
|
[FMT]D:1004 |
1 |
1 |
149 |
f |
[ANP]D:1001 |
x,y,z |
1_555 |
2 |
1 |
599 |
2.4 |
-0.2 |
0.371 |
0 |
0 |
0 |
0.006 |
61 |
79 |
|
[ANP]C:1001 |
1 |
1 |
603 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8708 |
1.3 |
0.0 |
0.565 |
0 |
0 |
0 |
0.000 |
80 |
|
[ANP]B:1001 |
1 |
1 |
604 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
8688 |
0.5 |
0.0 |
0.536 |
0 |
0 |
0 |
0.000 |
Average: |
0.9 |
0.0 |
0.550 |
0 |
0 |
0 |
0.000 |
|