Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7ff08d439ba9281bae427a6117fda4e0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 144.963,
"b": 98.636,
"c": 95.060,
"alpha": 90.00,
"beta": 128.07,
"gamma": 90.00
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.800],
"number_observations_unique": 95365,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.800],
"number_observations_unique": 9002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.592
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [1.940,1.860],
"number_observations_unique": 9530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.506
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
{
"resolution_limits": [2.030,1.940],
"number_observations_unique": 9616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.377
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
{
"resolution_limits": [2.130,2.030],
"number_observations_unique": 9631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.100
}
]
},
{
"resolution_limits": [2.270,2.130],
"number_observations_unique": 9651,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.212
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.200
}
]
},
{
"resolution_limits": [2.440,2.270],
"number_observations_unique": 9665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.200
}
]
},
{
"resolution_limits": [2.690,2.440],
"number_observations_unique": 9635,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.200
}
]
},
{
"resolution_limits": [3.080,2.690],
"number_observations_unique": 9622,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.200
}
]
},
{
"resolution_limits": [3.880,3.080],
"number_observations_unique": 9572,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 5.300
}
]
},
{
"resolution_limits": [50.000,3.880],
"number_observations_unique": 9441,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 5.300
}
]
}
]
}