Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1102556254d0651a82f2a7c793303566",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 66.649,
"b": 66.649,
"c": 153.960,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.500],
"number_observations_unique": 13095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 91.2
},
{
"type": "Redundancy",
"value": 6.7
}
]
},
"refln_shells": [
{
"resolution_limits": [2.570,2.500],
"number_observations_unique": 638,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "Completeness",
"value": 53.9
},
{
"type": "Redundancy",
"value": 5.1
}
]
},
{
"resolution_limits": [2.660,2.570],
"number_observations_unique": 751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "Completeness",
"value": 64.7
},
{
"type": "Redundancy",
"value": 5.1
}
]
},
{
"resolution_limits": [2.750,2.660],
"number_observations_unique": 944,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "Completeness",
"value": 80.2
},
{
"type": "Redundancy",
"value": 5.2
}
]
},
{
"resolution_limits": [2.860,2.750],
"number_observations_unique": 1109,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.212
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 5.6
}
]
},
{
"resolution_limits": [2.990,2.860],
"number_observations_unique": 1183,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.206
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.6
}
]
},
{
"resolution_limits": [3.150,2.990],
"number_observations_unique": 1167,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.3
}
]
},
{
"resolution_limits": [3.350,3.150],
"number_observations_unique": 1181,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.5
}
]
},
{
"resolution_limits": [3.610,3.350],
"number_observations_unique": 1180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.4
}
]
},
{
"resolution_limits": [3.970,3.610],
"number_observations_unique": 1201,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.5
}
]
},
{
"resolution_limits": [4.540,3.970],
"number_observations_unique": 1205,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.4
}
]
},
{
"resolution_limits": [5.720,4.540],
"number_observations_unique": 1232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.3
}
]
},
{
"resolution_limits": [50.000,5.720],
"number_observations_unique": 1304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 6.8
}
]
}
]
}