| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2005 | 30 | Yes |
Popular Name: ARG-GLY-ASP-SER ARG-GLY-ASP-SER
Find On: PubMed — Wikipedia — Google
CAS Number: 91037-65-9
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -5.37 | -4.78 | -154.71 | 12 | 15 | 0 | 279 | 433.422 | 15 | ↓ |
| Hi High (pH 8-9.5) | -5.37 | -5.12 | -121.45 | 11 | 15 | -1 | 277 | 432.414 | 15 | ↓ |
| Lo Low (pH 4.5-6) | -5.37 | -6.79 | -127.6 | 13 | 15 | 1 | 276 | 434.43 | 15 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ITA2B-1-E | Integrin Alpha-IIb (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9600 | 0.23 | Binding ≤ 10μM |
| ITA5-2-E | Fibronectin Receptor Alpha (cluster #2 Of 2), Eukaryotic | Eukaryotes | 2200 | 0.26 | Binding ≤ 10μM |
| ITB1-2-E | Fibronectin Receptor Beta (cluster #2 Of 2), Eukaryotic | Eukaryotes | 2200 | 0.26 | Binding ≤ 10μM |
| ITB3-1-E | Integrin Beta-3 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 9600 | 0.23 | Binding ≤ 10μM |
| ITA2B-1-E | Integrin Alpha-IIb (cluster #1 Of 2), Eukaryotic | Eukaryotes | 3500 | 0.25 | Functional ≤ 10μM |
| ITB3-1-E | Integrin Beta-3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 3500 | 0.25 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ITA2B_HUMAN | P08514 | Integrin Alpha-IIb, Human | 180 | 0.31 | Binding ≤ 1μM |
| ITB3_HUMAN | P05106 | Integrin Beta-3, Human | 180 | 0.31 | Binding ≤ 1μM |
| ITA5_HUMAN | P08648 | Fibronectin Receptor Alpha, Human | 2200 | 0.26 | Binding ≤ 10μM |
| ITB1_HUMAN | P05556 | Fibronectin Receptor Beta, Human | 2200 | 0.26 | Binding ≤ 10μM |
| ITA2B_HUMAN | P08514 | Integrin Alpha-IIb, Human | 180 | 0.31 | Binding ≤ 10μM |
| ITB3_HUMAN | P05106 | Integrin Beta-3, Human | 180 | 0.31 | Binding ≤ 10μM |
| ITA2B_HUMAN | P08514 | Integrin Alpha-IIb, Human | 3500 | 0.25 | Functional ≤ 10μM |
| ITB3_HUMAN | P05106 | Integrin Beta-3, Human | 3500 | 0.25 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Basigin interactions | |
| Cell surface interactions at the vascular wall | |
| CHL1 interactions | |
| ECM proteoglycans | |
| Elastic fibre formation | |
| Fibronectin matrix formation | |
| GRB2:SOS provides linkage to MAPK signaling for Integrins | |
| Immunoregulatory interactions between a Lymphoid and a non-Lymphoid cell | |
| Integrin alphaIIb beta3 signaling | |
| Integrin cell surface interactions | |
| Laminin interactions | |
| Localization of the PINCH-ILK-PARVIN complex to focal adhesions | |
| Molecules associated with elastic fibres | |
| Other semaphorin interactions | |
| p130Cas linkage to MAPK signaling for integrins | |
| PECAM1 interactions | |
| Platelet Adhesion to exposed collagen | |
| Platelet degranulation | |
| Signal transduction by L1 | |
| Syndecan interactions | |
| VEGFA-VEGFR2 Pathway |
