 
PDB ID
|
Resolution
|
Source
|
Class
|
Ligands
|
Binding Data
|
Molecular Weight (Da)
|
|---|---|---|---|---|---|---|
| 3AO4 | 1.95 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, CL, CD, 833 | Kd = 8.5 mM | 96.063, 35.453, 112.411, 217.224 |
| 3AO5 | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | GLC FRU, SO4, CL, CD, BBY | Kd = 5.9 mM | 340.281, 96.063, 35.453, 112.411, 296.12 |
| 3AO1 | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, CD, BZX | Kd = 5.5 mM | 96.063, 112.411, 138.121 |
| 1HYV | 1.7 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | TTA, SO4, CL | ic50 > 5 mM | 383.337, 96.063, 35.453 |
| 3OVN | 1.95 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | GLC FRU, SO4, MPV, CD | Kd = 2.8 mM | 340.281, 96.063, 179.242, 112.411 |
| 4CEB | 1.75 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | EDO, ACY, SO4, ZSV, GOL | Kd = 1080 uM | 62.068, 60.052, 96.063, 575.629, 92.094 |
| 4CJR | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | FYM, ACT, CL, SO4 | Kd = 793 uM | 492.52, 59.044, 35.453, 96.063 |
| 4CGI | 2.07 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | NZL, ACT, SO4 | Kd = 752 uM | 424.49, 59.044, 96.063 |
| 4CJ4 | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | CL, ACT, S3G, SO4 | Kd = 432 uM | 35.453, 59.044, 384.426, 96.063 |
| 1HYZ | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | CL, TTO, SO4 | ic50 = 380 uM | 35.453, 415.336, 96.063 |
| 3NF7 | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4 EDO, SO4, EDO, CIW, ACY | ic50 = 340 uM | 96.063, 62.068, 345.734, 60.052 |
| 3NF6 | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, IMV, EDO, CL, ACY | ic50 = 295 uM | 96.063, 311.289, 62.068, 35.453, 60.052 |
| 3NF9 | 1.95 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, EDO, CD9, ACY | ic50 = 290 uM | 96.063, 62.068, 345.734, 60.052 |
| 4CK3 | 1.79 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | K1T, SO4, ACT | Kd = 268 uM | 364.436, 96.063, 59.044 |
| 4CJQ | 1.7 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | VXO, SO4, ACT | Kd = 256 uM | 436.5, 96.063, 59.044 |
| 4CIG | 1.7 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | X0P, ACT, SO4 | Kd = 214 uM | 498.57, 59.044, 96.063 |
| 4CJ5 | 1.95 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | ACT, 4VW, CL, SO4 | Kd = 200 uM | 59.044, 398.452, 35.453, 96.063 |
| 3AO2 | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, MG, DTV, DTT, CL, CD, AVX | Kd = 0.17 mM | 96.063, 24.305, 154.251, 154.251, 35.453, 112.411, 296.12 |
| 1A30 | 2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GLU ASP LEU | Ki = 50 uM | 373.362 |
| 3R0W | 1.7 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | RSY | ic50 = 30.3 uM | 631.163 |
| 6U7O | 1.33 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | Q1D, NA, FMT, CL, GOL | Ki = 15.5 uM | 602.504, 22.99, 46.025, 35.453, 92.094 |
| 1AID | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | THK, CL | Ki = 15 uM | 452.048, 35.453 |
| 2AID | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | THK, CL | Ki = 15 uM | 452.048, 35.453 |
| 3R0Y | 1.65 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | RSZ | ic50 = 14.53 uM | 597.704 |
| 4EJD | 1.1 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | BME, 1F1, IVA VAL VAL STA ALA STA, GOL | Kd = 14.5 uM | 78.133, 161.157, 696.992, 92.094 |
| 4TSX | 1.94 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | SO4, LF0 | Kd = 10.3 uM | 96.063, 405.486 |
| 6VLM | 2.32 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | R2D | ic50 = 10 uM | 342.799 |
| 4EJL | 2.45 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | IOP, DMS, GOL, PEG | Kd = 7.2 uM | 189.211, 78.133, 92.094, 106.12 |
| 4EJK | 1.79 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | IOP, IVA VAL VAL STA ALA STA | Kd = 5.3 uM | 189.211, 696.992 |
| 6EB1 | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | J3M | ic50 = 4.65 uM | 467.556 |
| 1SGU | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | MK1 | Ki = 4235 nM | 613.789 |
| 4EJ8 | 2.35 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | EDO, 1F1, DMS | Kd = 4.1 uM | 62.068, 161.157, 78.133 |
| 2XDE | 1.4 | HUMAN IMMUNODEFICIENCY VIRUS 1 | NON-ENZYME OTHER | 1B0 | Kd = 3.42 uM | 425.522 |
| 4U7V | 1.38 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | BME, 3EN | Ki = 3.2 uM | 78.133, 524.675 |
| 1QS4 | 2.1 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | MG, 100 | ic50 = 2.3 uM | 24.305, 289.677 |
| 2PQZ | 1.55 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | G0G, CL | Ki = 2.15 uM | 561.715, 35.453 |
| 1GNN | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | U0E | Ki = 2100 nM | 596.762 |
| 2AVM | 1.1 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GOL, ACY, 2NC | Ki = 2 uM | 92.094, 60.052, 770.983 |
| 1XL2 | 1.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GOL, CL, 189 | Ki = 1.5 uM | 92.094, 35.453, 577.777 |
| 2R3T | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | G4G, CL | Ki = 1.4 uM | 647.764, 35.453 |
| 2HNY | 2.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.49 | PO4, NVP, MG | ic50 = 1165 nM | 94.971, 266.298, 24.305 |
| 1ZLF | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 0ZR | Ki = 1000 nM | 702.84 |
| 2R43 | 1.58 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GOL, G3G, CL | Ki = 1 uM | 92.094, 591.744, 35.453 |
| 1SH9 | 2.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | RIT | Ki = 932 nM | 720.944 |
| 4INB | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | NON-ENZYME OTHER | NA, 1F6 | ic50 = 0.89 uM | 22.99, 419.397 |
| 1MEU | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | DMP | Ki = 0.8 uM | 566.687 |
| 4HVP | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 2NC | Ki = 0.78 uM | 770.983 |
| 2QNQ | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | QN3, CL | Ki = 0.77 uM | 630.605, 35.453 |
| 2FGV | 1.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | QNC ASN HPH DIQ NTB, PO4 | Kd = 760 nM | 670.855, 94.971 |
| 6OPZ | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME HYDROLASES | 017 | Ki = 759.2 nM | 547.664 |
| 1GNM | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | U0E | Ki = 560 nM | 596.762 |
| 6O57 | 1.71 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME HYDROLASES | 2NC, FMT | Ki = 514 nM | 770.983, 46.025 |
| 6O5A | 1.67 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME HYDROLASES | GOL, 2NC | Ki = 514 nM | 92.094, 770.983 |
| 2ZGA | 1.65 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | YDP | Ki = 0.48 uM | 603.753 |
| 3CKT | 1.65 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | YDP, CL | Ki = 0.48 uM | 603.753, 35.453 |
| 6EB2 | 2.49 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | J3P | ic50 = 0.48 uM | 547.644 |
| 1BDQ | 2.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | IM1 | Ki = 460 nM | 534.69 |
| 1HBV | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GAN | Ki = 430 nM | 585.778 |
| 1RTH | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.49 | U05 | ic50 = 0.4 uM | 298.297 |
| 2QNP | 1.41 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | QN2, CL | Ki = 0.39 uM | 813.508, 35.453 |
| 3BVB | 1.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | NA, GOL, CL, 017 | Ka = 3170000 M^-1 | 22.99, 92.094, 35.453, 547.664 |
| 3BVA | 1.05 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GOL, 2NC | Ka = 3300000 M^-1 | 92.094, 770.983 |
| 2PWC | 1.78 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | G3G, CL, GOL | Ki = 0.27 uM | 591.744, 35.453, 92.094 |
| 4RZ8 | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | NON-ENZYME OTHER | EPE, NAG, 3ZM | ic50 ~ 270 nM | 238.305, 221.208, 444.978 |
| 2PWR | 1.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | GOL, G4G, CL | Ki = 0.26 uM | 92.094, 647.764, 35.453 |
| 4EYR | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | RIT | ic50 = 237 nM | 720.944 |
| 4XRQ | 1.95 | HUMAN IMMUNODEFICIENCY VIRUS 1 | NON-ENZYME OTHER | 1B0 | Kd = 0.232 uM | 425.522 |
| 4LH5 | 2.19 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | MG, LF0 | ic50 = 0.23 uM | 24.305, 405.486 |
| 5OI8 | 2.35 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | 9VN, SO4, MG | ic50 = 0.21 uM | 413.573, 96.063, 24.305 |
| 5OI5 | 2.4 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | MG, 9VK | ic50 = 0.19 uM | 24.305, 413.573 |
| 2AZC | 2.01 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 3TL | ic50 = 183 nM | 909.077 |
| 4J5J | 1.8 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 478, CL | Ka = 5610000 M^-1 | 505.627, 35.453 |
| 6OPX | 2.03 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME HYDROLASES | 017 | Ki = 172.7 nM | 547.664 |
| 5OI2 | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | MG, SO4, 9VN | ic50 = 0.17 uM | 24.305, 96.063, 413.573 |
| 5OIA | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | 9VK, SO4, MG | ic50 = 0.17 uM | 413.573, 96.063, 24.305 |
| 6UM8 | 2.33 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.7 | PEG, 1PE, SO4, QCG | Ki = 0.17 uM | 106.12, 238.278, 96.063, 503.565 |
| 6OPY | 2.13 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME HYDROLASES | 017 | Ki = 156.4 nM | 547.664 |
| 2PYM | 1.9 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 1UN | Kd = 150 nM | 567.782 |
| 1HTF | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | G26 | ic50 = 148 nM | 574.734 |
| 3AID | 2.5 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | ARQ | Ki = 137 nM | 504.64 |
| 2R3W | 1.92 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | G3G, CL | Ki = 0.128 uM | 591.744, 35.453 |
| 1K6V | 2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | XN2, ACT | Kd = 120 nM | 670.837, 59.044 |
| 2UY0 | 1.76 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | HV1 | Ki = 120 nM | 723.653 |
| 1A9M | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | U0E | Ki = 119 nM | 596.762 |
| 1TCX | 2.3 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | IM1 | Ki = 112 nM | 534.69 |
| 1ODW | 2.1 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 0E8 | Ki = 100 nM | 543.695 |
| 1VRU | 2.4 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.49 | AAP | ic50 = 0.1 uM | 351.227 |
| 1ZJ7 | 1.93 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 0ZT | Ki = 86 nM | 703.824 |
| 1VRT | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 2.7.7.49 | NVP, MG | ic50 = 0.08 uM | 266.298, 24.305 |
| 6O48 | 1.46 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | FMT, GOL, 0Q4, NA, CL | Ki = 75 nM | 46.025, 92.094, 833.053, 22.99, 35.453 |
| 2QNN | 1.48 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | QN1, GOL, CL | Ki = 0.07 uM | 783.76, 92.094, 35.453 |
| 1ZTZ | 2.15 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | CB5, ALA GLY ALA ALA | Ki = 66 nM | 323.749, 273.313 |
| 2Q63 | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 1UN | Kd = 66 nM | 567.782 |
| 1T7J | 2.2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | ACT, 478 | Kd = 0.000000064 M | 59.044, 505.627 |
| 2AZB | 2.03 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | 3TL | ic50 = 64 nM | 909.077 |
| 2PSV | 1.75 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | PO4, MUV, ACT | Ki = 58 nM | 94.971, 477.574, 59.044 |
| 1MRX | 2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | K57 | Kd = 55 nM | 527.675 |
| 6OGP | 1.53 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | EDO, MJD | ic50 = 0.055 uM | 62.068, 692.77 |
| 2QHZ | 1.85 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | PO4, MZ2 | Ki = 53 nM | 94.971, 606.6 |
| 2QI1 | 2 | HUMAN IMMUNODEFICIENCY VIRUS 1 | ENZYME 3.4.23.16 | PO4, MZ4 | Ki = 50 nM | 94.971, 582.688 |
