4IAX
Engineered human lipocalin 2 (CL31) in complex with Y-DTPA
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Neutrophil gelatinase-associated lipocalin | polymer | 188 | 21565.5 | 1 | UniProt (P80188) Pfam (PF00061) In PDB | Homo sapiens (human) | NGAL, 25 kDa alpha-2-microglobulin-related subunit of MMP-9, Lipocalin-2, Oncogene 24p3, Siderocalin LCN2, p25 |
2 | A | N-{(1S,2S)-2-[bis(carboxymethyl)amino]cyclohexyl}-N-{(2R)-2-[bis(carboxymethyl)amino]-3-[4-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]carbamothioyl}amino)phenyl]propyl}glycine | non-polymer | 715.8 | 1 | Chemie (LIZ) | |||
3 | A | YTTRIUM (III) ION | non-polymer | 88.9 | 1 | Chemie (YT3) | |||
4 | water | water | 18.0 | 116 | Chemie (HOH) |
Sequence modifications
A: 1 - 178 (UniProt: P80188)
PDB | External Database | Details |
---|---|---|
His 28 | Gln 48 | engineered mutation |
Gln 33 | Val 53 | engineered mutation |
Arg 36 | Leu 56 | engineered mutation |
Ala 41 | Ile 61 | engineered mutation |
Pro 42 | Leu 62 | engineered mutation |
Pro 43 | Arg 63 | engineered mutation |
Met 44 | Glu 64 | engineered mutation |
Pro 46 | Lys 66 | engineered mutation |
Glu 47 | Asp 67 | engineered mutation |
Leu 48 | Pro 68 | engineered mutation |
Leu 49 | Gln 69 | engineered mutation |
Leu 50 | Lys 70 | engineered mutation |
Leu 51 | Met 71 | engineered mutation |
Thr 52 | Tyr 72 | engineered mutation |
Gln 54 | Thr 74 | engineered mutation |
Thr 55 | Ile 75 | engineered mutation |
Asp 65 | Asn 85 | engineered mutation |
Ala 68 | Ser 88 | engineered mutation |
Arg 70 | Leu 90 | engineered mutation |
Met 75 | Lys 95 | engineered mutation |
Glu 77 | Asp 97 | engineered mutation |
Leu 79 | Trp 99 | engineered mutation |
Thr 80 | Ile 100 | engineered mutation |
Met 81 | Arg 101 | engineered mutation |
Ser 86 | Gly 106 | engineered mutation |
Pro 87 | Cys 107 | engineered mutation |
Asn 99 | Ser 119 | engineered mutation |
Phe 107 | Leu 127 | engineered mutation |
Gln 127 | Ser 147 | engineered mutation |
Ser 134 | Lys 154 | engineered mutation |
Ser 136 | Thr 156 | engineered mutation |
Leu 138 | Tyr 158 | engineered mutation |
Ala 145 | Thr 165 | engineered mutation |
Ser 179 | - | expression tag |
Ala 180 | - | expression tag |
Trp 181 | - | expression tag |
Ser 182 | - | expression tag |
His 183 | - | expression tag |
Pro 184 | - | expression tag |
Gln 185 | - | expression tag |
Phe 186 | - | expression tag |
Glu 187 | - | expression tag |
Lys 188 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 21565.5 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 804.7 | |
All* | Total formula weight | 22370.2 |