4HW2A

Discovery of potent mcl-1 inhibitors using fragment-based methods and structure-based design
Total Genus 50
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The genus trace: a function that shows values of genus (vertical axis) for subchains spanned between the first residue, and all other residues (shown on horizontal axis). The number of the latter residue and the genus of a given subchain are shown interactively.

Total Genus
50
sequence length
151
structure length
149
Chain Sequence
GDELYRQSLEIISRYLREQATGAKDTKPMSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHV
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The genus matrix. At position (x,y) a genus value for a subchain spanned between x’th and y’th residue is shown. Values of the genus are represented by color, according to the scale given on the right.

Structure visualization

After clicking on a point (x,y) in the genus matrix above, a subchain from x to y is shown in color.

publication title Discovery of potent myeloid cell leukemia 1 (Mcl-1) inhibitors using fragment-based methods and structure-based design.
pubmed doi rcsb
molecule keywords Induced myeloid leukemia cell differentiation protein Mcl-1
molecule tags Apoptosis/inhibitor
source organism Homo sapiens
total genus 50
structure length 149
sequence length 151
chains with identical sequence B, C, D, E, F
ec nomenclature
pdb deposition date 2012-11-07

pfam database annotations

chain Pfam Accession Code Pfam Family Identifier Pfam Description
A PF00452 Bcl-2 Apoptosis regulator proteins, Bcl-2 family
Image from the rcsb pdb (www.rcsb.org)
cath code
ClassArchitectureTopologyHomologyDomain
1.10.437.10 Mainly Alpha Orthogonal Bundle Apoptosis Regulator Bcl-x Blc2-like 4hw2A01
1Q59A 4OYDA 4BD7A 2VOHA 2ME8A 1YSIA 3WIYA 2XPXA 4YJ4A 3KJ2A 2KBWA 1F16A 1YSWA 1YSGA 2PQKA 3I1HA 2ROCA 1R2EA 2O2MA 2VOGA 2VOFA 4G35A 1MK3A 2A5YA 4BD6A 3KJ0A 2VOIA 1YSNA 2W3LA 2K7WA 3D7VA 5JSBA 3IIGA 3IIHA 1G5JA 2JM6B 4ZIIA 4U2VA 2V6QA 4QVXA 2RODA 4S0OA 1K3KA 3PK1A 4BD2A 5KTGA 4ZEQA 2ABOA 1LXLA 1DDBA 3IO9A 4WMRA 2YV6A 3IHEA 5FC4A 4S0PA 2O22A 1MAZA 2BIDA 2JCNA 3ILCA 4BD8A 2NL9A 2IMTA 4ZIGA 5C6HA 2M5BA 4ZBIA 2IMSA 5IEZA 4BPIA 2O2NA 1R2GA 3IHCA 4ZIFA 1G5MA 2B48A 5IF4A 3KZ0A 2WH6A 2MHSA 4MI8A 3MQPA 1WSXA 1ZY3A 1BXLA 2KUAA 4B4SA 2MEJA 5FDOA 5FDRA 4OQ5A 3KJ1A 4YK9A 3WIXA 4HW3A 1O0LA 4OQ6A 3CVAX 2VM6A 5KU9A 3BL2A 1AF3A 4U2UA 1OHUA 4BPJA 2O21A 2XA0A 4QNQA 2O2FA 3DVUA 2NLAA 2LR1A 1PQ1A 4ZIHA 3QBRA 4HW2A 4K5BC 1GJHA 1R2HA 5FMIA 4ZBFA 1TY4A 1R2IA 1PQ0A 3MK8A 5C3FA 4HW4A 2BZWA 4ZIEA 1R2DA 3IHDA 4BDUA
chains in the Genus database with same CATH superfamily
1Q59A 4OYDA 4BD7A 2VOHA 2ME8A 1YSIA 3WIYA 2XPXA 4YJ4A 3KJ2A 2KBWA 4UF2A 1F16A 1YSWA 1YSGA 2PQKA 3I1HA 2ROCA 4BBCA 1R2EA 2O2MA 2JBYA 2VOGA 2VOFA 4G35A 1MK3A 2A5YA 4BD6A 3KJ0A 2VOIA 1YSNA 2W3LA 2K7WA 3D7VA 4M0SA 5JSBA 4D2MA 3IIGA 3IIHA 1G5JA 2JM6B 4ZIIA 2JBXA 4U2VA 2V6QA 4QVXA 2RODA 2VVXA 4S0OA 1K3KA 2K36A 3PK1A 4BD2A 5KTGA 4ZEQA 2ABOA 1LXLA 2I39A 1DDBA 3IO9A 4WMRA 2YV6A 4BBBA 3IHEA 5FC4A 4LQKA 4S0PA 2O22A 1MAZA 2BIDA 2JCNA 2VTYA 3ILCA 2NL9A 4BD8A 4BBDA 2IMTA 4ZIGA 2VVYA 5C6HA 2M5BA 4ZBIA 2IMSA 5IEZA 4BPIA 2O2NA 1R2GA 3IHCA 4ZIFA 1G5MA 2B48A 5IF4A 3KZ0A 2WH6A 2MHSA 4MI8A 3MQPA 1WSXA 1ZY3A 1BXLA 2KUAA 4B4SA 2MEJA 5FDOA 3JRVA 5FDRA 4OQ5A 3KJ1A 4YK9A 3WIXA 4HW3A 1O0LA 4OQ6A 3CVAX 2VVWA 2VM6A 5KU9A 3BL2A 1AF3A 4U2UA 1OHUA 4BPJA 2O42A 2O21A 2XA0A 4UF3A 2O2FA 3DVUA 4QNQA 2NLAA 2LR1A 1PQ1A 4ZIHA 3QBRA 4HW2A 4K5BC 1GJHA 1R2HA 5FMIA 4ZBFA 1TY4A 1R2IA 2UXEA 4D2LA 1PQ0A 3MK8A 5C3FA 4HW4A 2BZWA 4ZIEA 1R2DA 3IHDA 4BDUA 4UF1A
chains in the Genus database with same CATH topology
1Q59A 4OYDA 4BD7A 2VOHA 2ME8A 1YSIA 3WIYA 2XPXA 4YJ4A 3KJ2A 2KBWA 1F16A 1YSWA 1YSGA 2PQKA 3I1HA 2ROCA 1R2EA 2O2MA 2VOGA 2VOFA 4G35A 1MK3A 2A5YA 4BD6A 3KJ0A 2VOIA 1YSNA 2W3LA 2K7WA 3D7VA 5JSBA 3IIGA 3IIHA 1G5JA 2JM6B 4ZIIA 4U2VA 2V6QA 4QVXA 2RODA 4S0OA 1K3KA 3PK1A 4BD2A 5KTGA 4ZEQA 2ABOA 1LXLA 1DDBA 3IO9A 4WMRA 2YV6A 3IHEA 5FC4A 4S0PA 2O22A 1MAZA 2BIDA 2JCNA 3ILCA 4BD8A 2NL9A 2IMTA 4ZIGA 5C6HA 2M5BA 4ZBIA 2IMSA 5IEZA 4BPIA 2O2NA 1R2GA 3IHCA 4ZIFA 1G5MA 2B48A 5IF4A 3KZ0A 2WH6A 2MHSA 4MI8A 3MQPA 1WSXA 1ZY3A 1BXLA 2KUAA 4B4SA 2MEJA 5FDOA 5FDRA 4OQ5A 3KJ1A 4YK9A 3WIXA 4HW3A 1O0LA 4OQ6A 3CVAX 2VM6A 5KU9A 3BL2A 1AF3A 4U2UA 1OHUA 4BPJA 2O21A 2XA0A 4QNQA 2O2FA 3DVUA 2NLAA 2LR1A 1PQ1A 4ZIHA 3QBRA 4HW2A 4K5BC 1GJHA 1R2HA 5FMIA 4ZBFA 1TY4A 1R2IA 1PQ0A 3MK8A 5C3FA 4HW4A 2BZWA 4ZIEA 1R2DA 3IHDA 4BDUA
chains in the Genus database with same CATH homology


 
#chains in the Genus database with same CATH superfamily
 1Q59 A;  4OYD A;  4BD7 A;  2VOH A;  2ME8 A;  1YSI A;  3WIY A;  2XPX A;  4YJ4 A;  3KJ2 A;  2KBW A;  1F16 A;  1YSW A;  1YSG A;  2PQK A;  3I1H A;  2ROC A;  1R2E A;  2O2M A;  2VOG A;  2VOF A;  4G35 A;  1MK3 A;  2A5Y A;  4BD6 A;  3KJ0 A;  2VOI A;  1YSN A;  2W3L A;  2K7W A;  3D7V A;  5JSB A;  3IIG A;  3IIH A;  1G5J A;  2JM6 B;  4ZII A;  4U2V A;  2V6Q A;  4QVX A;  2ROD A;  4S0O A;  1K3K A;  3PK1 A;  4BD2 A;  5KTG A;  4ZEQ A;  2ABO A;  1LXL A;  1DDB A;  3IO9 A;  4WMR A;  2YV6 A;  3IHE A;  5FC4 A;  4S0P A;  2O22 A;  1MAZ A;  2BID A;  2JCN A;  3ILC A;  4BD8 A;  2NL9 A;  2IMT A;  4ZIG A;  5C6H A;  2M5B A;  4ZBI A;  2IMS A;  5IEZ A;  4BPI A;  2O2N A;  1R2G A;  3IHC A;  4ZIF A;  1G5M A;  2B48 A;  5IF4 A;  3KZ0 A;  2WH6 A;  2MHS A;  4MI8 A;  3MQP A;  1WSX A;  1ZY3 A;  1BXL A;  2KUA A;  4B4S A;  2MEJ A;  5FDO A;  5FDR A;  4OQ5 A;  3KJ1 A;  4YK9 A;  3WIX A;  4HW3 A;  1O0L A;  4OQ6 A;  3CVA X;  2VM6 A;  5KU9 A;  3BL2 A;  1AF3 A;  4U2U A;  1OHU A;  4BPJ A;  2O21 A;  2XA0 A;  4QNQ A;  2O2F A;  3DVU A;  2NLA A;  2LR1 A;  1PQ1 A;  4ZIH A;  3QBR A;  4HW2 A;  4K5B C;  1GJH A;  1R2H A;  5FMI A;  4ZBF A;  1TY4 A;  1R2I A;  1PQ0 A;  3MK8 A;  5C3F A;  4HW4 A;  2BZW A;  4ZIE A;  1R2D A;  3IHD A;  4BDU A; 
#chains in the Genus database with same CATH topology
 1Q59 A;  4OYD A;  4BD7 A;  2VOH A;  2ME8 A;  1YSI A;  3WIY A;  2XPX A;  4YJ4 A;  3KJ2 A;  2KBW A;  4UF2 A;  1F16 A;  1YSW A;  1YSG A;  2PQK A;  3I1H A;  2ROC A;  4BBC A;  1R2E A;  2O2M A;  2JBY A;  2VOG A;  2VOF A;  4G35 A;  1MK3 A;  2A5Y A;  4BD6 A;  3KJ0 A;  2VOI A;  1YSN A;  2W3L A;  2K7W A;  3D7V A;  4M0S A;  5JSB A;  4D2M A;  3IIG A;  3IIH A;  1G5J A;  2JM6 B;  4ZII A;  2JBX A;  4U2V A;  2V6Q A;  4QVX A;  2ROD A;  2VVX A;  4S0O A;  1K3K A;  2K36 A;  3PK1 A;  4BD2 A;  5KTG A;  4ZEQ A;  2ABO A;  1LXL A;  2I39 A;  1DDB A;  3IO9 A;  4WMR A;  2YV6 A;  4BBB A;  3IHE A;  5FC4 A;  4LQK A;  4S0P A;  2O22 A;  1MAZ A;  2BID A;  2JCN A;  2VTY A;  3ILC A;  2NL9 A;  4BD8 A;  4BBD A;  2IMT A;  4ZIG A;  2VVY A;  5C6H A;  2M5B A;  4ZBI A;  2IMS A;  5IEZ A;  4BPI A;  2O2N A;  1R2G A;  3IHC A;  4ZIF A;  1G5M A;  2B48 A;  5IF4 A;  3KZ0 A;  2WH6 A;  2MHS A;  4MI8 A;  3MQP A;  1WSX A;  1ZY3 A;  1BXL A;  2KUA A;  4B4S A;  2MEJ A;  5FDO A;  3JRV A;  5FDR A;  4OQ5 A;  3KJ1 A;  4YK9 A;  3WIX A;  4HW3 A;  1O0L A;  4OQ6 A;  3CVA X;  2VVW A;  2VM6 A;  5KU9 A;  3BL2 A;  1AF3 A;  4U2U A;  1OHU A;  4BPJ A;  2O42 A;  2O21 A;  2XA0 A;  4UF3 A;  2O2F A;  3DVU A;  4QNQ A;  2NLA A;  2LR1 A;  1PQ1 A;  4ZIH A;  3QBR A;  4HW2 A;  4K5B C;  1GJH A;  1R2H A;  5FMI A;  4ZBF A;  1TY4 A;  1R2I A;  2UXE A;  4D2L A;  1PQ0 A;  3MK8 A;  5C3F A;  4HW4 A;  2BZW A;  4ZIE A;  1R2D A;  3IHD A;  4BDU A;  4UF1 A; 
#chains in the Genus database with same CATH homology
 1Q59 A;  4OYD A;  4BD7 A;  2VOH A;  2ME8 A;  1YSI A;  3WIY A;  2XPX A;  4YJ4 A;  3KJ2 A;  2KBW A;  1F16 A;  1YSW A;  1YSG A;  2PQK A;  3I1H A;  2ROC A;  1R2E A;  2O2M A;  2VOG A;  2VOF A;  4G35 A;  1MK3 A;  2A5Y A;  4BD6 A;  3KJ0 A;  2VOI A;  1YSN A;  2W3L A;  2K7W A;  3D7V A;  5JSB A;  3IIG A;  3IIH A;  1G5J A;  2JM6 B;  4ZII A;  4U2V A;  2V6Q A;  4QVX A;  2ROD A;  4S0O A;  1K3K A;  3PK1 A;  4BD2 A;  5KTG A;  4ZEQ A;  2ABO A;  1LXL A;  1DDB A;  3IO9 A;  4WMR A;  2YV6 A;  3IHE A;  5FC4 A;  4S0P A;  2O22 A;  1MAZ A;  2BID A;  2JCN A;  3ILC A;  4BD8 A;  2NL9 A;  2IMT A;  4ZIG A;  5C6H A;  2M5B A;  4ZBI A;  2IMS A;  5IEZ A;  4BPI A;  2O2N A;  1R2G A;  3IHC A;  4ZIF A;  1G5M A;  2B48 A;  5IF4 A;  3KZ0 A;  2WH6 A;  2MHS A;  4MI8 A;  3MQP A;  1WSX A;  1ZY3 A;  1BXL A;  2KUA A;  4B4S A;  2MEJ A;  5FDO A;  5FDR A;  4OQ5 A;  3KJ1 A;  4YK9 A;  3WIX A;  4HW3 A;  1O0L A;  4OQ6 A;  3CVA X;  2VM6 A;  5KU9 A;  3BL2 A;  1AF3 A;  4U2U A;  1OHU A;  4BPJ A;  2O21 A;  2XA0 A;  4QNQ A;  2O2F A;  3DVU A;  2NLA A;  2LR1 A;  1PQ1 A;  4ZIH A;  3QBR A;  4HW2 A;  4K5B C;  1GJH A;  1R2H A;  5FMI A;  4ZBF A;  1TY4 A;  1R2I A;  1PQ0 A;  3MK8 A;  5C3F A;  4HW4 A;  2BZW A;  4ZIE A;  1R2D A;  3IHD A;  4BDU A; 
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similar chains in the Genus database (?% sequence similarity)
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similar chains in the pdb database (?% sequence similarity)

 
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#similar chains, but unknotted
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